N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-3-phenylsulfanyl-propanamide Openeye Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-3-phenylsulfanyl-propanamide CAS Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-3-(phenylthio)propanamide IUPAC Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-3-phenylsulfanylpropanamide Traditional Name: N-(5-keto-1-phenyl-3-pyrazolin-3-yl)-3-(phenylthio)propionamide Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C=C(N2)NC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C=C(N2)NC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S/c22-17(11-12-24-15-9-5-2-6-10-15)19-16-13-18(23)21(20-16)14-7-3-1-4-8-14/h1-10,13,20H,11-12H2,(H,19,22)