N-[3-[1-[(4-methylphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-4-nitro-benzamide

Systemtic Name: N-[3-[1-[(4-methylphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-4-nitro-benzamide Openeye Name: 4-nitro-N-[3-[1-(p-tolylcarbamoyl)propylsulfanyl]phenyl]benzamide CAS Name: N-[3-[[1-(4-methylanilino)-1-oxobutan-2-yl]thio]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-[1-(4-methylanilino)-1-oxobutan-2-yl]sulfanylphenyl]-4-nitrobenzamide Traditional Name: 4-nitro-N-[3-[1-(p-tolylcarbamoyl)propylthio]phenyl]benzamide Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O4S/c1-3-22(24(29)25-18-11-7-16(2)8-12-18)32-21-6-4-5-19(15-21)26-23(28)17-9-13-20(14-10-17)27(30)31/h4-15,22H,3H2,1-2H3,(H,25,29)(H,26,28)