N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-2-thiophen-2-ylsulfanyl-butanamide

Systemtic Name: N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-2-thiophen-2-ylsulfanyl-butanamide Openeye Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-(2-thienylsulfanyl)butanamide CAS Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-(thiophen-2-ylthio)butanamide IUPAC Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-thiophen-2-ylsulfanylbutanamide Traditional Name: N-(5-keto-1-phenyl-3-pyrazolin-3-yl)-2-(2-thienylthio)butyramide Formula: C17H17N3O2S2 MolecularWeight: 359.46578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=O)N(N1)C2=CC=CC=C2)SC3=CC=CS3

Isomeric SMILES

CCC(C(=O)NC1=CC(=O)N(N1)C2=CC=CC=C2)SC3=CC=CS3

InChI

InChI=1S/C17H17N3O2S2/c1-2-13(24-16-9-6-10-23-16)17(22)18-14-11-15(21)20(19-14)12-7-4-3-5-8-12/h3-11,13,19H,2H2,1H3,(H,18,22)