N-[4-(cyanomethyl)phenyl]-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-[methyl(p-tolylsulfonyl)amino]benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-[methyl(tosyl)amino]benzamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C23H21N3O3S/c1-17-3-13-22(14-4-17)30(28,29)26(2)21-11-7-19(8-12-21)23(27)25-20-9-5-18(6-10-20)15-16-24/h3-14H,15H2,1-2H3,(H,25,27)