2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: 2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: N-(benzylcarbamoyl)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: N-(benzylcarbamoyl)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(benzylcarbamoyl)-2-[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC1=CC=CC=C1)SC2=NNC(=O)N2C3CC3

Isomeric SMILES

CC(C(=O)NC(=O)NCC1=CC=CC=C1)SC2=NNC(=O)N2C3CC3

InChI

InChI=1S/C16H19N5O3S/c1-10(25-16-20-19-15(24)21(16)12-7-8-12)13(22)18-14(23)17-9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3,(H,19,24)(H2,17,18,22,23)