[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-methylphenyl)sulfonylpiperidin-4-yl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Openeye Name: [1-(p-tolylsulfonyl)-4-piperidyl]-[4-(8-quinolylmethyl)piperazin-1-yl]methanone CAS Name: [1-(4-methylphenyl)sulfonyl-4-piperidinyl]-[4-(8-quinolinylmethyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-methylphenyl)sulfonylpiperidin-4-yl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Traditional Name: [4-(8-quinolylmethyl)piperazino]-(1-tosyl-4-piperidyl)methanone Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C27H32N4O3S/c1-21-7-9-25(10-8-21)35(33,34)31-14-11-23(12-15-31)27(32)30-18-16-29(17-19-30)20-24-5-2-4-22-6-3-13-28-26(22)24/h2-10,13,23H,11-12,14-20H2,1H3