1-[4-[4-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[6-(1-piperidylsulfonyl)-2-quinolyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[6-(1-piperidinylsulfonyl)-2-quinolinyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(6-piperidin-1-ylsulfonylquinolin-2-yl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(6-piperidinosulfonyl-2-quinolyl)piperazino]phenyl]ethanone Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C26H30N4O3S/c1-20(31)21-5-8-23(9-6-21)28-15-17-29(18-16-28)26-12-7-22-19-24(10-11-25(22)27-26)34(32,33)30-13-3-2-4-14-30/h5-12,19H,2-4,13-18H2,1H3