N-(3-chloranyl-2-methyl-phenyl)-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-1-(2-cyanophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-1-(2-cyanophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-1-(2-cyanophenyl)sulfonyl-isonipecotamide Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C20H20ClN3O3S/c1-14-17(21)6-4-7-18(14)23-20(25)15-9-11-24(12-10-15)28(26,27)19-8-3-2-5-16(19)13-22/h2-8,15H,9-12H2,1H3,(H,23,25)