N-(2-methyl-3-nitro-phenyl)-2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]benzamide

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]benzamide Openeye Name: 2-[benzyl(p-tolylsulfonyl)amino]-N-(2-methyl-3-nitro-phenyl)benzamide CAS Name: N-(2-methyl-3-nitrophenyl)-2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]benzamide IUPAC Name: 2-[benzyl-(4-methylphenyl)sulfonylamino]-N-(2-methyl-3-nitrophenyl)benzamide Traditional Name: 2-[benzyl(tosyl)amino]-N-(2-methyl-3-nitro-phenyl)benzamide Formula: C28H25N3O5S MolecularWeight: 515.5802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=C(C(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=C(C(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C28H25N3O5S/c1-20-15-17-23(18-16-20)37(35,36)30(19-22-9-4-3-5-10-22)27-13-7-6-11-24(27)28(32)29-25-12-8-14-26(21(25)2)31(33)34/h3-18H,19H2,1-2H3,(H,29,32)