N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-nitro-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-nitro-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-nitro-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]benzenesulfonamide CAS Name: N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-4-nitro-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-4-nitrobenzenesulfonamide Traditional Name: N-benzyl-N-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-4-nitro-benzenesulfonamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H25N3O4S/c1-21-8-5-6-11-23(21)19-27-17-7-12-25(27)20-28(18-22-9-3-2-4-10-22)34(32,33)26-15-13-24(14-16-26)29(30)31/h2-17H,18-20H2,1H3