2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)-N-(phenylmethyl)ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-benzyl-N-(m-tolyl)acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(3-methylphenyl)-N-(phenylmethyl)acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-benzyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-benzyl-N-(m-tolyl)acetamide Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC2=CC=CC=C2)C(=O)CSC3=NNC(=N3)N

Isomeric SMILES

CC1=CC(=CC=C1)N(CC2=CC=CC=C2)C(=O)CSC3=NNC(=N3)N

InChI

InChI=1S/C18H19N5OS/c1-13-6-5-9-15(10-13)23(11-14-7-3-2-4-8-14)16(24)12-25-18-20-17(19)21-22-18/h2-10H,11-12H2,1H3,(H3,19,20,21,22)