4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-[(4-methylphenyl)-phenyl-methyl]benzamide

Systemtic Name: 4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-[(4-methylphenyl)-phenyl-methyl]benzamide Openeye Name: 4-[(3-chloro-N-methylsulfonyl-anilino)methyl]-N-[phenyl(p-tolyl)methyl]benzamide CAS Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-[(4-methylphenyl)-phenylmethyl]benzamide IUPAC Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-[(4-methylphenyl)-phenylmethyl]benzamide Traditional Name: 4-[(3-chloro-N-mesyl-anilino)methyl]-N-[phenyl(p-tolyl)methyl]benzamide Formula: C29H27ClN2O3S MolecularWeight: 519.05428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN(C4=CC(=CC=C4)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN(C4=CC(=CC=C4)Cl)S(=O)(=O)C

InChI

InChI=1S/C29H27ClN2O3S/c1-21-11-15-24(16-12-21)28(23-7-4-3-5-8-23)31-29(33)25-17-13-22(14-18-25)20-32(36(2,34)35)27-10-6-9-26(30)19-27/h3-19,28H,20H2,1-2H3,(H,31,33)