N-[4-(cyanomethyl)phenyl]-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzamide Openeye Name: 2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-N-[4-(cyanomethyl)phenyl]benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]benzamide IUPAC Name: 2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-[4-(cyanomethyl)phenyl]benzamide Traditional Name: 2-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-N-[4-(cyanomethyl)phenyl]benzamide Formula: C29H25N3O4S MolecularWeight: 511.5915

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)CC#N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)CC#N

InChI

InChI=1S/C29H25N3O4S/c1-36-25-15-17-26(18-16-25)37(34,35)32(21-23-7-3-2-4-8-23)28-10-6-5-9-27(28)29(33)31-24-13-11-22(12-14-24)19-20-30/h2-18H,19,21H2,1H3,(H,31,33)