N-[(4-methylphenyl)methyl]-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Openeye Name: 1-[6-(1-piperidylsulfonyl)-2-quinolyl]-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-1-[6-(1-piperidinylsulfonyl)-2-quinolinyl]-3-piperidinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-1-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperidine-3-carboxamide Traditional Name: N-(4-methylbenzyl)-1-(6-piperidinosulfonyl-2-quinolyl)nipecotamide Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C28H34N4O3S/c1-21-7-9-22(10-8-21)19-29-28(33)24-6-5-15-31(20-24)27-14-11-23-18-25(12-13-26(23)30-27)36(34,35)32-16-3-2-4-17-32/h7-14,18,24H,2-6,15-17,19-20H2,1H3,(H,29,33)