3-chloranyl-N-[4-(cyanomethyl)phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide

Systemtic Name: 3-chloranyl-N-[4-(cyanomethyl)phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide Openeye Name: 3-chloro-N-[4-(cyanomethyl)phenyl]-4-(p-tolylsulfonylamino)benzamide CAS Name: 3-chloro-N-[4-(cyanomethyl)phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: 3-chloro-N-[4-(cyanomethyl)phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide Traditional Name: 3-chloro-N-[4-(cyanomethyl)phenyl]-4-(tosylamino)benzamide Formula: C22H18ClN3O3S MolecularWeight: 439.91462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N)Cl

InChI

InChI=1S/C22H18ClN3O3S/c1-15-2-9-19(10-3-15)30(28,29)26-21-11-6-17(14-20(21)23)22(27)25-18-7-4-16(5-8-18)12-13-24/h2-11,14,26H,12H2,1H3,(H,25,27)