2-(4-methylphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)quinoline-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)quinoline-4-carboxamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 2-(4-methylphenyl)-N-[3-(1-piperidinylsulfonyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)quinoline-4-carboxamide Traditional Name: N-(3-piperidinosulfonylphenyl)-2-(p-tolyl)cinchoninamide Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C28H27N3O3S/c1-20-12-14-21(15-13-20)27-19-25(24-10-3-4-11-26(24)30-27)28(32)29-22-8-7-9-23(18-22)35(33,34)31-16-5-2-6-17-31/h3-4,7-15,18-19H,2,5-6,16-17H2,1H3,(H,29,32)