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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C)SC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C)SC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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