N-[4-(2-cyanopropan-2-yl)phenyl]-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(2-cyanopropan-2-yl)phenyl]-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(3-acetylphenyl)sulfonyl-N-[4-(1-cyano-1-methyl-ethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(3-acetylphenyl)sulfonyl-N-[4-(2-cyanopropan-2-yl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-acetylphenyl)sulfonyl-N-[4-(2-cyanopropan-2-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3-acetylphenyl)sulfonyl-N-[4-(1-cyano-1-methyl-ethyl)phenyl]isonipecotamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C(C)(C)C#N

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C(C)(C)C#N

InChI

InChI=1S/C24H27N3O4S/c1-17(28)19-5-4-6-22(15-19)32(30,31)27-13-11-18(12-14-27)23(29)26-21-9-7-20(8-10-21)24(2,3)16-25/h4-10,15,18H,11-14H2,1-3H3,(H,26,29)