Substances (GSRS)

2H,3H-Imidazo[1,5-a]pyrazine-3-thione

Also: 2H-Imidazo[1,5-a]pyrazine-3-thione, Imidazo[1,5-a]pyrazine-3(2H)-thione, Imidazo[1,5-a]pyrazine-3-thiol +1

chemicalUNII TW4ZA2A7UF
Open FDA's page for this record
Substance class
chemical
Definition type
PRIMARY
Definition level
COMPLETE
Uuid
919fb618-3293-43ce-8ea4-1c24e329c957
Version
7
UNII
TW4ZA2A7UF
Codes
  1. Uuid
    df84dacb-b009-f2a7-074d-fb5912d1d482
    Code
    DTXSID40394233
    Type
    PRIMARY
    Url
    https://comptox.epa.gov/dashboard/chemical/details/DTXSID40394233
    Code system
    EPA CompTox
    References
    8646725e-b194-eb5a-10dd-1905861f55c7
  2. Uuid
    e33ebd78-29de-4120-89cc-ca47c52b561a
    Code
    3613753
    Type
    PRIMARY
    Url
    https://pubchem.ncbi.nlm.nih.gov/compound/3613753
    Code system
    PUBCHEM
  3. Uuid
    2fff796e-c13f-4c19-90b1-0d24501d0903
    Code
    56488-16-5
    Type
    PRIMARY
    Url
    https://commonchemistry.cas.org/detail?cas_rn=56488-16-5
    Code system
    CAS
    References
    4bd57a92-a910-44ec-8c8b-c90219d94ac4
  4. Uuid
    29d9df63-2bb0-4f61-88c5-c7a79e5414ce
    Code
    TW4ZA2A7UF
    Type
    PRIMARY
    Code system
    FDA UNII
  5. Uuid
    63da9a9d-4282-5b73-3991-845971493bcf
    Code
    169566
    Type
    PRIMARY
    Url
    https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=169566
    Code system
    NSC
    References
    d2df451b-1ea9-a44a-5e07-1e86db242080
Names
  1. Uuid
    eaa998f8-d62a-43c3-b140-8706c6ce6f1b
    Name
    2H,3H-Imidazo[1,5-a]pyrazine-3-thione
    StdName
    2H,3H-IMIDAZO(1,5-A)PYRAZINE-3-THIONE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    4bd57a92-a910-44ec-8c8b-c90219d94ac4
  2. Uuid
    12388345-9614-49e3-b929-d50b7d55207f
    Name
    2H-Imidazo[1,5-a]pyrazine-3-thione
    StdName
    2H-IMIDAZO(1,5-A)PYRAZINE-3-THIONE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    4bd57a92-a910-44ec-8c8b-c90219d94ac4
  3. Uuid
    52c39ffe-b302-4e1a-abc5-a2ca47c018b6
    Name
    Imidazo[1,5-a]pyrazine-3(2H)-thione
    StdName
    IMIDAZO(1,5-A)PYRAZINE-3(2H)-THIONE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    4bd57a92-a910-44ec-8c8b-c90219d94ac4
  4. Uuid
    8fc16830-8fad-452f-b2af-6be3835cdcc8
    Name
    Imidazo[1,5-a]pyrazine-3-thiol
    StdName
    IMIDAZO(1,5-A)PYRAZINE-3-THIOL
    Type
    cn
    Preferred
    false
    Display name
    true
    Languages
    en
    References
    7c84ec18-e027-4316-9eaa-0592d4bfcb25
  5. Uuid
    66663f24-a9fb-4718-880e-b246d1ea7e56
    Name
    NSC-169566
    StdName
    NSC-169566
    Type
    cd
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    4bd57a92-a910-44ec-8c8b-c90219d94ac4
References
  1. Uuid
    7c84ec18-e027-4316-9eaa-0592d4bfcb25
    Citation
    PUBCHEM
    Url
    https://pubchem.ncbi.nlm.nih.gov/compound/3613753
    Doc type
    PUBCHEM
    Public domain
    true
    Tags
    PUBLIC_DOMAIN_RELEASE, NOMEN
  2. Uuid
    d2df451b-1ea9-a44a-5e07-1e86db242080
    Citation
    NCI
    Doc type
    NCI DRUG DICTIONARY
    Public domain
    true
  3. Uuid
    8646725e-b194-eb5a-10dd-1905861f55c7
    Citation
    EPA CompTox
    Doc type
    EPA
    Public domain
    true
  4. Uuid
    4bd57a92-a910-44ec-8c8b-c90219d94ac4
    Citation
    STN
    Doc type
    STN (SCIFINDER)
    Public domain
    true
    Tags
    PUBLIC_DOMAIN_RELEASE
Moieties
  1. Uuid
    7bfd9773-bed5-4479-82a3-b7a106413fa1
    ID
    7bfd9773-bed5-4479-82a3-b7a106413fa1
    Smiles
    c1cn2c(cn1)c[nH]c2=S
    Formula
    C6H5N3S
    Atropisomerism
    No
    Charge
    0
    Count
    1
    Stereochemistry
    ACHIRAL
    Defined stereo
    0
    Ez centers
    0
    Molecular weight
    151.1903
    Optical activity
    NONE
    Stereo centers
    0
    Molfile

    Marvin 08312118262D 10 11 0 0 0 0 999 V2000 1.0804 -1.3069 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8255 -0.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3104 0.1452 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8255 0.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0408 0.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6736 0.9702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3881 0.5577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3881 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6736 -0.6798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0408 -0.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 M END

    Count amount
    Type
    MOL RATIO
    Average
    1
    Units
    MOL RATIO
    Uuid
    f75c7cbe-72e6-49c2-b726-41a22be495a4
Structure
ID
34fbfaee-9800-49a4-a81f-9156d56b0324
Smiles
c1cn2c(cn1)c[nH]c2=S
Formula
C6H5N3S
Atropisomerism
No
Charge
0
Count
1
Stereochemistry
ACHIRAL
Defined stereo
0
Ez centers
0
Molecular weight
151.1903
Optical activity
NONE
Stereo centers
0
Molfile

JSDraw208312114262D 10 11 0 0 0 0 0 V2000 25.8283 -9.8488 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 25.3464 -8.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.2632 -7.1031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 25.3464 -5.8412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8626 -6.3231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5118 -5.5432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1608 -6.3231 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.1608 -7.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5118 -8.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8626 -7.8831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 5 10 1 0 0 0 0 2 10 1 0 0 0 0 M END

References
4bd57a92-a910-44ec-8c8b-c90219d94ac4
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