2-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[3-(4-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-methyl-acetamide CAS Name: 2-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methylacetamide Traditional Name: N-benzyl-2-[3-(4-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-methyl-acetamide Formula: C18H17ClN4OS MolecularWeight: 372.87178

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN4OS/c1-22(11-13-5-3-2-4-6-13)16(24)12-23-17(20-21-18(23)25)14-7-9-15(19)10-8-14/h2-10H,11-12H2,1H3,(H,21,25)