4-[3-(4-nitrophenyl)-3-oxidanylidene-1-phenylsulfanyl-propyl]benzamide

Systemtic Name: 4-[3-(4-nitrophenyl)-3-oxidanylidene-1-phenylsulfanyl-propyl]benzamide Openeye Name: 4-[3-(4-nitrophenyl)-3-oxo-1-phenylsulfanyl-propyl]benzamide CAS Name: 4-[3-(4-nitrophenyl)-3-oxo-1-(phenylthio)propyl]benzamide IUPAC Name: 4-[3-(4-nitrophenyl)-3-oxo-1-phenylsulfanylpropyl]benzamide Traditional Name: 4-[3-keto-3-(4-nitrophenyl)-1-(phenylthio)propyl]benzamide Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)SC(CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C22H18N2O4S/c23-22(26)17-8-6-16(7-9-17)21(29-19-4-2-1-3-5-19)14-20(25)15-10-12-18(13-11-15)24(27)28/h1-13,21H,14H2,(H2,23,26)