N-(1-imidazol-1-ylpropan-2-yl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: N-(1-imidazol-1-ylpropan-2-yl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide Openeye Name: N-(2-imidazol-1-yl-1-methyl-ethyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[1-(1-imidazolyl)propan-2-yl]-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-(1-imidazol-1-ylpropan-2-yl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide Traditional Name: N-(2-imidazol-1-yl-1-methyl-ethyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=O)NC(C)CN3C=CN=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=O)NC(C)CN3C=CN=C3

InChI

InChI=1S/C17H20N6OS/c1-12-4-3-5-14(8-12)16-20-21-17(25)23(16)10-15(24)19-13(2)9-22-7-6-18-11-22/h3-8,11,13H,9-10H2,1-2H3,(H,19,24)(H,21,25)