Substances (GSRS)

1H-Imidazole-1-ethanol, α-(chloromethyl)-2-methyl-5-nitro-, hydrochloride (1:1), (αS)-

Also: Ornidazole hydrochloride, (S)-

chemicalUNII MVF25V4F3K

Open FDA's page for this record

Substance class

chemical

Definition type

PRIMARY

Definition level

COMPLETE

Uuid

c4ca7692-ed06-4412-956a-c0179a70cc0e

Version

UNII

MVF25V4F3K

Codes

Uuid
00009359-27a9-4cce-8525-1f2cb9b67b0f
Code
MVF25V4F3K
Type
PRIMARY
Code system
FDA UNII
Uuid
30f338a6-f3a5-430f-91cd-ad38d9bc5266
Code
940892-75-1
Type
PRIMARY
Url
https://commonchemistry.cas.org/detail?cas_rn=940892-75-1
Code system
CAS
References
1b088025-4335-4470-b592-15b4524e5b20, 844758da-d5cb-4a4e-ae5f-a163bda9ceee

Names

Uuid
214491cf-abcd-45fc-a4f6-c89836ee5944
Name
1H-Imidazole-1-ethanol, α-(chloromethyl)-2-methyl-5-nitro-, hydrochloride (1:1), (αS)-
StdName
1H-IMIDAZOLE-1-ETHANOL, .ALPHA.-(CHLOROMETHYL)-2-METHYL-5-NITRO-, HYDROCHLORIDE (1:1), (.ALPHA.S)-
Type
sys
Preferred
false
Display name
false
Languages
en
References
139e6c78-019d-4199-bba3-a74016e7b0ae, ae0d6b08-6e66-4446-a361-b47ee85ba1c3
Uuid
96fbb712-b557-4a57-83a8-15574ca80f30
Name
Ornidazole hydrochloride, (S)-
StdName
ORNIDAZOLE HYDROCHLORIDE, (S)-
Type
cn
Preferred
false
Display name
true
Languages
en
References
7c411407-cbca-447d-82c4-aeb2abf16a2b, ae0d6b08-6e66-4446-a361-b47ee85ba1c3

References

Uuid
7c411407-cbca-447d-82c4-aeb2abf16a2b
Citation
STN
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
ae0d6b08-6e66-4446-a361-b47ee85ba1c3
Citation
STN (SCIFINDER)
Doc type
STN (SCIFINDER)
Public domain
true
Tags
PUBLIC_DOMAIN_RELEASE
Uuid
139e6c78-019d-4199-bba3-a74016e7b0ae
Citation
FDA_SRS
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
1b088025-4335-4470-b592-15b4524e5b20
Citation
SRS CODE IMPORT
Doc type
SRS
Public domain
true
Document date
1493393042000
Tags
NOMEN
Uuid
844758da-d5cb-4a4e-ae5f-a163bda9ceee
Citation
STN
Doc type
STN (SCIFINDER)
Public domain
true

Moieties

Uuid
c2a5d5d3-f93e-4f3a-9601-be7eed704953
ID
c2a5d5d3-f93e-4f3a-9601-be7eed704953
Molfile
Marvin 10262217492D 1 0 0 0 1 0 999 V2000 13.8625 -5.7256 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 M END
Smiles
Cl
Formula
ClH
Atropisomerism
No
Charge
0
Count
1
Stereochemistry
ACHIRAL
Defined stereo
0
Ez centers
0
Molecular weight
36.4609
Optical activity
NONE
Stereo centers
0
Count amount
Type
MOL RATIO
Average
1
Units
MOL RATIO
Uuid
d456ea75-428c-4ff8-82fa-5c432fcd5f8a
Uuid
d66c6077-21c1-48c9-b514-d9880b2fb0ee
ID
d66c6077-21c1-48c9-b514-d9880b2fb0ee
Smiles
Cc1ncc(n1C[C@@H](CCl)O)[N+](=O)[O-]
Formula
C7H10ClN3O3
Atropisomerism
No
Charge
0
Count
1
Stereochemistry
ABSOLUTE
Defined stereo
1
Ez centers
0
Molecular weight
219.6258
Optical activity
UNSPECIFIED
Stereo centers
1
Molfile
Marvin 10262217492D 14 14 0 0 1 0 999 V2000 13.5547 -4.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3752 -4.2652 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.8600 -4.9326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6807 -4.8464 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.7107 -3.5114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0697 -3.6840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2447 -3.6840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7598 -4.3514 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.0954 -5.1051 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.9394 -4.2652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9898 -2.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6573 -2.4145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3247 -2.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1093 -2.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 6 0 0 0 3 4 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 11 12 1 0 0 0 0 13 12 2 0 0 0 0 13 14 1 0 0 0 0 M CHG 2 8 1 9 -1 M END
Count amount
Type
MOL RATIO
Average
1
Units
MOL RATIO
Uuid
18b825c4-c63a-48a5-b66a-053c974aedc6

Structure

ID: 08f46368-db0c-49f8-960d-161586bb6482
Smiles: Cc1ncc(n1C[C@@H](CCl)O)[N+](=O)[O-].Cl
Formula: C7H10ClN3O3.ClH
Atropisomerism: No
Charge: 0
Count: 1
Stereochemistry: ABSOLUTE
Defined stereo: 1
Ez centers: 0
Molecular weight: 256.0867
Optical activity: ( - )
Stereo centers: 1
Molfile: JSDraw210262217492D 15 14 0 0 1 0 0 V2000 25.6307 -8.2280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1822 -8.0650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.0989 -9.3270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.6506 -9.1640 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 27.8166 -6.6398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.7136 -6.9660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.1536 -6.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2367 -8.2280 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 22.8713 -9.6532 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 20.6854 -8.0650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6716 -5.4824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9338 -4.5655 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 25.1958 -5.4824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6794 -5.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.2127 -10.8265 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 2 5 1 6 0 0 0 1 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 7 11 2 0 0 0 0 11 12 1 0 0 0 0 13 12 2 0 0 0 0 6 13 1 0 0 0 0 13 14 1 0 0 0 0 M CHG 2 8 1 9 -1 M END
References: 7c411407-cbca-447d-82c4-aeb2abf16a2b, 844758da-d5cb-4a4e-ae5f-a163bda9ceee

Modifications

Uuid: 6037bc25-9af7-45b2-a8ae-e083275114b8

Data from openFDA, FDA's public API. FDA says not to rely on it to make decisions about medical care and to treat every result as unvalidated; confirm against FDA's own record and the product labeling. Not medical or legal advice.