N-[3-[[ethanoyl(methyl)amino]methyl]phenyl]-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide

Systemtic Name: N-[3-[[ethanoyl(methyl)amino]methyl]phenyl]-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-[3-[[acetyl(methyl)amino]methyl]phenyl]-3-nitro-4-(p-tolylsulfanyl)benzamide CAS Name: N-[3-[[acetyl(methyl)amino]methyl]phenyl]-4-[(4-methylphenyl)thio]-3-nitrobenzamide IUPAC Name: N-[3-[[acetyl(methyl)amino]methyl]phenyl]-4-(4-methylphenyl)sulfanyl-3-nitrobenzamide Traditional Name: N-[3-[[acetyl(methyl)amino]methyl]phenyl]-3-nitro-4-(p-tolylthio)benzamide Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)CN(C)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)CN(C)C(=O)C)[N+](=O)[O-]

InChI

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