N-(4-ethanoylphenyl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide

Systemtic Name: N-(4-ethanoylphenyl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide Openeye Name: N-(4-acetylphenyl)-2-(4-methylsulfanyl-3-nitro-benzoyl)benzamide CAS Name: N-(4-acetylphenyl)-2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]benzamide IUPAC Name: N-(4-acetylphenyl)-2-(4-methylsulfanyl-3-nitrobenzoyl)benzamide Traditional Name: N-(4-acetylphenyl)-2-[4-(methylthio)-3-nitro-benzoyl]benzamide Formula: C23H18N2O5S MolecularWeight: 434.46442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)SC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)SC)[N+](=O)[O-]

InChI

InChI=1S/C23H18N2O5S/c1-14(26)15-7-10-17(11-8-15)24-23(28)19-6-4-3-5-18(19)22(27)16-9-12-21(31-2)20(13-16)25(29)30/h3-13H,1-2H3,(H,24,28)