U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H18ClN3O4S
Molecular Weight 395.861
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-CHLORO-N-(((5S)-3-(4-((2-HYDROXYETHYL)AMINO)PHENYL)-2-OXO-5-OXAZOLIDINYL)METHYL)-2-THIOPHENECARBOXAMIDE

SMILES

OCCNC1=CC=C(C=C1)N2C[C@H](CNC(=O)C3=CC=C(Cl)S3)OC2=O

InChI

InChIKey=SHYGJDDTGJVQSP-ZDUSSCGKSA-N
InChI=1S/C17H18ClN3O4S/c18-15-6-5-14(26-15)16(23)20-9-13-10-21(17(24)25-13)12-3-1-11(2-4-12)19-7-8-22/h1-6,13,19,22H,7-10H2,(H,20,23)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H18ClN3O4S
Molecular Weight 395.861
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:07:37 GMT 2023
Edited
by admin
on Sat Dec 16 10:07:37 GMT 2023
Record UNII
H57733YY13
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-CHLORO-N-(((5S)-3-(4-((2-HYDROXYETHYL)AMINO)PHENYL)-2-OXO-5-OXAZOLIDINYL)METHYL)-2-THIOPHENECARBOXAMIDE
Systematic Name English
2-THIOPHENECARBOXAMIDE, 5-CHLORO-N-(((5S)-3-(4-((2-HYDROXYETHYL)AMINO)PHENYL)-2-OXO-5-OXAZOLIDINYL)METHYL)-
Systematic Name English
RIVAROXABAN M6
Common Name English
Code System Code Type Description
CAS
936232-22-3
Created by admin on Sat Dec 16 10:07:37 GMT 2023 , Edited by admin on Sat Dec 16 10:07:37 GMT 2023
PRIMARY
FDA UNII
H57733YY13
Created by admin on Sat Dec 16 10:07:37 GMT 2023 , Edited by admin on Sat Dec 16 10:07:37 GMT 2023
PRIMARY
RS_ITEM_NUM
1A01470
Created by admin on Sat Dec 16 10:07:37 GMT 2023 , Edited by admin on Sat Dec 16 10:07:37 GMT 2023
PRIMARY
PUBCHEM
59190906
Created by admin on Sat Dec 16 10:07:37 GMT 2023 , Edited by admin on Sat Dec 16 10:07:37 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MINOR
FECAL; URINE