2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenyl-acetamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenylacetamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SC(C2=CC=CC=C2)C(=O)NC3CC3

Isomeric SMILES

CCCCN1C(=O)NN=C1SC(C2=CC=CC=C2)C(=O)NC3CC3

InChI

InChI=1S/C17H22N4O2S/c1-2-3-11-21-16(23)19-20-17(21)24-14(12-7-5-4-6-8-12)15(22)18-13-9-10-13/h4-8,13-14H,2-3,9-11H2,1H3,(H,18,22)(H,19,23)