N-[3-(piperidin-1-ylmethyl)phenyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(piperidin-1-ylmethyl)phenyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-isopropylphenyl)sulfonyl-N-[3-(1-piperidylmethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[3-(1-piperidinylmethyl)phenyl]-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(piperidin-1-ylmethyl)phenyl]-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-p-cumenylsulfonyl-N-[3-(piperidinomethyl)phenyl]isonipecotamide Formula: C27H37N3O3S MolecularWeight: 483.66598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)CN4CCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)CN4CCCCC4

InChI

InChI=1S/C27H37N3O3S/c1-21(2)23-9-11-26(12-10-23)34(32,33)30-17-13-24(14-18-30)27(31)28-25-8-6-7-22(19-25)20-29-15-4-3-5-16-29/h6-12,19,21,24H,3-5,13-18,20H2,1-2H3,(H,28,31)