2-(2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFINYL)-1-(4-PYRIDINYLMETHYL)-1H-IMIDAZOL-4-YL)-1,2-PROPANEDIOL

Details

Stereochemistry	MIXED
Molecular Formula	C20H20Cl2N4O5S
Molecular Weight	499.368
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFINYL)-1-(4-PYRIDINYLMETHYL)-1H-IMIDAZOL-4-YL)-1,2-PROPANEDIOL

Structure Search

SMILES

CC(O)(CO)C1=C(N(CC2=CC=NC=C2)C(COC(N)=O)=N1)[S+]([O-])C3=CC(Cl)=CC(Cl)=C3

InChI

InChIKey=NSACELCXKZQXTE-UHFFFAOYSA-N

InChI=1S/C20H20Cl2N4O5S/c1-20(29,11-27)17-18(32(30)15-7-13(21)6-14(22)8-15)26(9-12-2-4-24-5-3-12)16(25-17)10-31-19(23)28/h2-8,27,29H,9-11H2,1H3,(H2,23,28)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

2-(2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFINYL)-1-(4-PYRIDINYLMETHYL)-1H-IMIDAZOL-4-YL)-1,2-PROPANEDIOL

Systematic Name

English

1,2-PROPANEDIOL, 2-(2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFINYL)-1-(4-PYRIDINYLMETHYL)-1H-IMIDAZOL-4-YL)-

Systematic Name

English

CAPRAVIRINE METABOLITE C3

Common Name

English

Code System Code Type Description

PUBCHEM

156028044

Created by admin on Sat Dec 16 16:35:55 GMT 2023 , Edited by admin on Sat Dec 16 16:35:55 GMT 2023

PRIMARY

CAS

757211-21-5

Created by admin on Sat Dec 16 16:35:55 GMT 2023 , Edited by admin on Sat Dec 16 16:35:55 GMT 2023

PRIMARY

FDA UNII

WA2E3EQT7T

Created by admin on Sat Dec 16 16:35:55 GMT 2023 , Edited by admin on Sat Dec 16 16:35:55 GMT 2023

PRIMARY

PARENT (METABOLITE)


					VHC779598X

CAPRAVIRINE

SUBSTANCE RECORD


					WA2E3EQT7T

2-(2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFINYL)-1-(4-PYRIDINYLMETHYL)-1H-IMIDAZOL-4-YL)-1,2-PROPANEDIOL