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

Approval Year

Unknown
139594
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
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966