6-(4-methylpiperidin-1-yl)sulfonyl-N-phenethyl-2-pyridin-3-yl-quinoline-4-carboxamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCCC4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCCC4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C29H30N4O3S/c1-21-12-16-33(17-13-21)37(35,36)24-9-10-27-25(18-24)26(19-28(32-27)23-8-5-14-30-20-23)29(34)31-15-11-22-6-3-2-4-7-22/h2-10,14,18-21H,11-13,15-17H2,1H3,(H,31,34)