2-(4-chlorophenyl)-N-[(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[[[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]thiocarbamoyl]acetamide Formula: C14H16ClN5OS2 MolecularWeight: 369.89274

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1NC(=S)NC(=O)CC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCSC1=NN=C(N1NC(=S)NC(=O)CC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C14H16ClN5OS2/c1-3-23-14-18-17-9(2)20(14)19-13(22)16-12(21)8-10-4-6-11(15)7-5-10/h4-7H,3,8H2,1-2H3,(H2,16,19,21,22)