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

Systemtic Name: 4-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[4-(cyanomethyl)phenyl]benzamide Openeye Name: 4-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[4-(cyanomethyl)phenyl]benzamide CAS Name: 4-[(4-chlorophenyl)sulfonyl-methylamino]-N-[4-(cyanomethyl)phenyl]benzamide IUPAC Name: 4-[(4-chlorophenyl)sulfonyl-methylamino]-N-[4-(cyanomethyl)phenyl]benzamide Traditional Name: 4-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[4-(cyanomethyl)phenyl]benzamide Formula: C22H18ClN3O3S MolecularWeight: 439.91462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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