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Details

Stereochemistry ACHIRAL
Molecular Formula C20H20Cl2N4O4S
Molecular Weight 483.368
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1H-IMIDAZOLE-2,4-DIMETHANOL, 5-((3,5-DICHLOROPHENYL)THIO)-.ALPHA.4,.ALPHA.4-DIMETHYL-1-((1-OXIDO-4-PYRIDINYL)METHYL)-, .ALPHA.2-CARBAMATE

SMILES

CC(C)(O)C1=C(SC2=CC(Cl)=CC(Cl)=C2)N(CC3=CC=[N+]([O-])C=C3)C(COC(N)=O)=N1

InChI

InChIKey=KDVGKVCTHBGUDG-UHFFFAOYSA-N
InChI=1S/C20H20Cl2N4O4S/c1-20(2,28)17-18(31-15-8-13(21)7-14(22)9-15)26(16(24-17)11-30-19(23)27)10-12-3-5-25(29)6-4-12/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)THIO)-.ALPHA.4,.ALPHA.4-DIMETHYL-1-((1-OXIDO-4-PYRIDINYL)METHYL)-, .ALPHA.2-CARBAMATE
Systematic Name English
CAPRAVIRINE METABOLITE C12
Common Name English
Code System Code Type Description
CAS
757211-34-0
Created by admin on Sat Dec 16 16:34:09 GMT 2023 , Edited by admin on Sat Dec 16 16:34:09 GMT 2023
PRIMARY
PUBCHEM
11511393
Created by admin on Sat Dec 16 16:34:09 GMT 2023 , Edited by admin on Sat Dec 16 16:34:09 GMT 2023
PRIMARY
FDA UNII
EKR5H9BQ5Q
Created by admin on Sat Dec 16 16:34:09 GMT 2023 , Edited by admin on Sat Dec 16 16:34:09 GMT 2023
PRIMARY