N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[4-(3-methylpiperidino)sulfonylphenyl]-2-phenyl-cinchoninamide Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H27N3O3S/c1-20-8-7-17-31(19-20)35(33,34)23-15-13-22(14-16-23)29-28(32)25-18-27(21-9-3-2-4-10-21)30-26-12-6-5-11-24(25)26/h2-6,9-16,18,20H,7-8,17,19H2,1H3,(H,29,32)