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

Details

Stereochemistry ACHIRAL
Molecular Formula C24H24ClNOS
Molecular Weight 409.971
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-(.ALPHA.-(P-CHLOROPHENYL)-P-CUMENYL) M,N-DIMETHYLTHIOCARBANILATE

SMILES

CN(C(=S)OC1=CC=C(C=C1)C(C)(C)C2=CC=C(Cl)C=C2)C3=CC(C)=CC=C3

InChI

InChIKey=YGPVVPVUQVQKNO-UHFFFAOYSA-N
InChI=1S/C24H24ClNOS/c1-17-6-5-7-21(16-17)26(4)23(28)27-22-14-10-19(11-15-22)24(2,3)18-8-12-20(25)13-9-18/h5-16H,1-4H3

HIDE SMILES / InChI

Molecular Formula C24H24ClNOS
Molecular Weight 409.971
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:26:32 GMT 2023
Edited
by admin
on Fri Dec 15 15:26:32 GMT 2023
Record UNII
4AJ9MB5RGF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-(.ALPHA.-(P-CHLOROPHENYL)-P-CUMENYL) M,N-DIMETHYLTHIOCARBANILATE
Common Name English
O-(4-(2-(4-CHLOROPHENYL)PROPAN-2-YL)PHENYL) N-METHYL-N-(3-METHYLPHENYL)CARBAMOTHIOATE
Systematic Name English
CARBANILIC ACID, M,N-DIMETHYLTHIO-, O-(.ALPHA.-(P-CHLOROPHENYL)-P-CUMENYL) ESTER
Common Name English
PHENOL, P-(P-CHLORO-.ALPHA.,.ALPHA.-DIMETHYLBENZYL)-, M,N-DIMETHYLTHIOCARBANILATE
Common Name English
CARBAMOTHIOIC ACID, METHYL(3-METHYLPHENYL)-, O-(4-(1-(4-CHLOROPHENYL)-1-METHYLETHYL)PHENYL) ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
4AJ9MB5RGF
Created by admin on Fri Dec 15 15:26:32 GMT 2023 , Edited by admin on Fri Dec 15 15:26:32 GMT 2023
PRIMARY
CAS
6399-25-3
Created by admin on Fri Dec 15 15:26:32 GMT 2023 , Edited by admin on Fri Dec 15 15:26:32 GMT 2023
PRIMARY
PUBCHEM
22903
Created by admin on Fri Dec 15 15:26:32 GMT 2023 , Edited by admin on Fri Dec 15 15:26:32 GMT 2023
PRIMARY