1-(4-methylphenyl)sulfonyl-N-quinolin-3-yl-piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-quinolin-3-yl-piperidine-4-carboxamide Openeye Name: 1-(p-tolylsulfonyl)-N-(3-quinolyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-(3-quinolinyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-quinolin-3-ylpiperidine-4-carboxamide Traditional Name: N-(3-quinolyl)-1-tosyl-isonipecotamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C22H23N3O3S/c1-16-6-8-20(9-7-16)29(27,28)25-12-10-17(11-13-25)22(26)24-19-14-18-4-2-3-5-21(18)23-15-19/h2-9,14-15,17H,10-13H2,1H3,(H,24,26)