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Details

Stereochemistry RACEMIC
Molecular Formula C20H20Cl2N4O4S
Molecular Weight 483.368
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1H-IMIDAZOLE-2,4-DIMETHANOL, 5-((3,5-DICHLOROPHENYL)SULFINYL)-.ALPHA.4,.ALPHA.4-DIMETHYL-1-(4-PYRIDINYLMETHYL)-, 2-CARBAMATE

SMILES

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

InChI

InChIKey=LENWSJTYMYQSKU-UHFFFAOYSA-N
InChI=1S/C20H20Cl2N4O4S/c1-20(2,28)17-18(31(29)15-8-13(21)7-14(22)9-15)26(10-12-3-5-24-6-4-12)16(25-17)11-30-19(23)27/h3-9,28H,10-11H2,1-2H3,(H2,23,27)

HIDE SMILES / InChI

Approval Year

Name Type Language
1H-IMIDAZOLE-2,4-DIMETHANOL, 5-((3,5-DICHLOROPHENYL)SULFINYL)-.ALPHA.4,.ALPHA.4-DIMETHYL-1-(4-PYRIDINYLMETHYL)-, 2-CARBAMATE
Systematic Name English
CAPRAVIRINE METABOLITE C9/M7
Common Name English
Code System Code Type Description
PUBCHEM
156596443
Created by admin on Sat Dec 16 16:34:39 GMT 2023 , Edited by admin on Sat Dec 16 16:34:39 GMT 2023
PRIMARY
FDA UNII
E3CEZ64VR2
Created by admin on Sat Dec 16 16:34:39 GMT 2023 , Edited by admin on Sat Dec 16 16:34:39 GMT 2023
PRIMARY
CAS
757211-28-2
Created by admin on Sat Dec 16 16:34:39 GMT 2023 , Edited by admin on Sat Dec 16 16:34:39 GMT 2023
PRIMARY