1H-IMIDAZOLE-4-ACETIC ACID, 2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFONYL)-.ALPHA.-METHYL-1-(4-PYRIDINYLMETHYL)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C20H18Cl2N4O6S
Molecular Weight	513.351
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1H-IMIDAZOLE-4-ACETIC ACID, 2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFONYL)-.ALPHA.-METHYL-1-(4-PYRIDINYLMETHYL)-

Structure Search

SMILES

CC(C(O)=O)C1=C(N(CC2=CC=NC=C2)C(COC(N)=O)=N1)S(=O)(=O)C3=CC(Cl)=CC(Cl)=C3

InChI

InChIKey=WYOXLWNSUJRBRE-UHFFFAOYSA-N

InChI=1S/C20H18Cl2N4O6S/c1-11(19(27)28)17-18(33(30,31)15-7-13(21)6-14(22)8-15)26(9-12-2-4-24-5-3-12)16(25-17)10-32-20(23)29/h2-8,11H,9-10H2,1H3,(H2,23,29)(H,27,28)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

1H-IMIDAZOLE-4-ACETIC ACID, 2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFONYL)-.ALPHA.-METHYL-1-(4-PYRIDINYLMETHYL)-

Systematic Name

English

2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFONYL)-.ALPHA.-METHYL-1-(4-PYRIDINYLMETHYL)-1H-IMIDAZOLE-4-ACETIC ACID

Common Name

English

CAPRAVIRINE METABOLITE C16

Common Name

English

Code System Code Type Description

CAS

757211-41-9

Created by admin on Sat Dec 16 16:08:56 GMT 2023 , Edited by admin on Sat Dec 16 16:08:56 GMT 2023

PRIMARY

PUBCHEM

156614155

Created by admin on Sat Dec 16 16:08:56 GMT 2023 , Edited by admin on Sat Dec 16 16:08:56 GMT 2023

PRIMARY

FDA UNII

BZ45AR2SES

Created by admin on Sat Dec 16 16:08:56 GMT 2023 , Edited by admin on Sat Dec 16 16:08:56 GMT 2023

PRIMARY

PARENT (METABOLITE)


					VHC779598X

CAPRAVIRINE

SUBSTANCE RECORD


					BZ45AR2SES

1H-IMIDAZOLE-4-ACETIC ACID, 2-(((AMINOCARBONYL)OXY)METHYL)-5-((3,5-DICHLOROPHENYL)SULFONYL)-.ALPHA.-METHYL-1-(4-PYRIDINYLMETHYL)-