3-oxidanylidene-N-phenyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide

Systemtic Name: 3-oxidanylidene-N-phenyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide Openeye Name: 3-oxo-N-phenyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide CAS Name: 3-oxo-N-phenyl-4-(1H-1,2,4-triazol-5-ylthio)butanamide IUPAC Name: 3-oxo-N-phenyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide Traditional Name: 3-keto-N-phenyl-4-(1H-1,2,4-triazol-5-ylthio)butyramide Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CC(=O)CSC2=NC=NN2

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CC(=O)CSC2=NC=NN2

InChI

InChI=1S/C12H12N4O2S/c17-10(7-19-12-13-8-14-16-12)6-11(18)15-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,15,18)(H,13,14,16)