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

Systemtic Name: 2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)propanamide Openeye Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(m-tolyl)propanamide CAS Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(3-methylphenyl)propanamide IUPAC Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)propanamide Traditional Name: 2-[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(m-tolyl)propionamide Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)SC2=NNC(=O)N2C3CC3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(C)SC2=NNC(=O)N2C3CC3

InChI

InChI=1S/C15H18N4O2S/c1-9-4-3-5-11(8-9)16-13(20)10(2)22-15-18-17-14(21)19(15)12-6-7-12/h3-5,8,10,12H,6-7H2,1-2H3,(H,16,20)(H,17,21)