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Details

Stereochemistry ACHIRAL
Molecular Formula C16H16ClNS3
Molecular Weight 353.953
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-[3-(2-Buten-1-ylthio)-4-chlorophenyl]-2-methyl-3-thiophenecarbothioamide

SMILES

C\C=C\CSC1=CC(NC(=S)C2=C(C)SC=C2)=CC=C1Cl

InChI

InChIKey=NLFLVHAFOCGXJG-ONEGZZNKSA-N
InChI=1S/C16H16ClNS3/c1-3-4-8-21-15-10-12(5-6-14(15)17)18-16(19)13-7-9-20-11(13)2/h3-7,9-10H,8H2,1-2H3,(H,18,19)/b4-3+

HIDE SMILES / InChI

Molecular Formula C16H16ClNS3
Molecular Weight 353.953
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:57:34 GMT 2023
Edited
by admin
on Sat Dec 16 12:57:34 GMT 2023
Record UNII
6BC4BX4B6Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-[3-(2-Buten-1-ylthio)-4-chlorophenyl]-2-methyl-3-thiophenecarbothioamide
Systematic Name English
3-THIOPHENECARBOTHIOAMIDE, N-(4-CHLORO-3-((2E)-BUTENYLTHIO)PHENYL)-2-METHYL-
Systematic Name English
3-Thiophenecarbothioamide, N-[3-(2-buten-1-ylthio)-4-chlorophenyl]-2-methyl-
Systematic Name English
UC-040
Code English
NSC-676509
Code English
Code System Code Type Description
FDA UNII
6BC4BX4B6Q
Created by admin on Sat Dec 16 12:57:34 GMT 2023 , Edited by admin on Sat Dec 16 12:57:34 GMT 2023
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CAS
178870-04-7
Created by admin on Sat Dec 16 12:57:34 GMT 2023 , Edited by admin on Sat Dec 16 12:57:34 GMT 2023
PRIMARY
PUBCHEM
5468799
Created by admin on Sat Dec 16 12:57:34 GMT 2023 , Edited by admin on Sat Dec 16 12:57:34 GMT 2023
PRIMARY
NSC
676509
Created by admin on Sat Dec 16 12:57:34 GMT 2023 , Edited by admin on Sat Dec 16 12:57:34 GMT 2023
PRIMARY