N-[(4-methylphenyl)methyl]-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-[(4-methyl-1-piperidyl)sulfonyl]-N-(p-tolylmethyl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-6-[(4-methyl-1-piperidinyl)sulfonyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(4-methylbenzyl)-6-(4-methylpiperidino)sulfonyl-2-(3-pyridyl)cinchoninamide Formula: C29H30N4O3S MolecularWeight: 514.6385

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCC4=CC=C(C=C4)C)C5=CN=CC=C5

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCC4=CC=C(C=C4)C)C5=CN=CC=C5

InChI

InChI=1S/C29H30N4O3S/c1-20-5-7-22(8-6-20)18-31-29(34)26-17-28(23-4-3-13-30-19-23)32-27-10-9-24(16-25(26)27)37(35,36)33-14-11-21(2)12-15-33/h3-10,13,16-17,19,21H,11-12,14-15,18H2,1-2H3,(H,31,34)