N-(2-chlorophenyl)-3-methyl-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide

Systemtic Name: N-(2-chlorophenyl)-3-methyl-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide Openeye Name: N-(2-chlorophenyl)-3-methyl-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide CAS Name: N-(2-chlorophenyl)-3-methyl-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]butanamide IUPAC Name: N-(2-chlorophenyl)-3-methyl-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N-(2-chlorophenyl)-2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]-3-methyl-butyramide Formula: C16H21ClN4O2S MolecularWeight: 368.88154

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SC(C(C)C)C(=O)NC2=CC=CC=C2Cl

Isomeric SMILES

CCCN1C(=O)NN=C1SC(C(C)C)C(=O)NC2=CC=CC=C2Cl

InChI

InChI=1S/C16H21ClN4O2S/c1-4-9-21-15(23)19-20-16(21)24-13(10(2)3)14(22)18-12-8-6-5-7-11(12)17/h5-8,10,13H,4,9H2,1-3H3,(H,18,22)(H,19,23)