N-[(4-methylphenyl)-phenyl-methyl]-2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[(4-methylphenyl)-phenyl-methyl]-2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-nitro-anilino]-N-[phenyl(p-tolyl)methyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]-N-[(4-methylphenyl)-phenylmethyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]-N-[(4-methylphenyl)-phenylmethyl]acetamide Traditional Name: 2-(N-besyl-4-nitro-anilino)-N-[phenyl(p-tolyl)methyl]acetamide Formula: C28H25N3O5S MolecularWeight: 515.5802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CN(C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CN(C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H25N3O5S/c1-21-12-14-23(15-13-21)28(22-8-4-2-5-9-22)29-27(32)20-30(24-16-18-25(19-17-24)31(33)34)37(35,36)26-10-6-3-7-11-26/h2-19,28H,20H2,1H3,(H,29,32)