8-[4-(2-methylpropyl)piperazin-1-yl]-3-(phenylsulfonyl)quinoline

Systemtic Name: 8-[4-(2-methylpropyl)piperazin-1-yl]-3-(phenylsulfonyl)quinoline Openeye Name: 3-(benzenesulfonyl)-8-(4-isobutylpiperazin-1-yl)quinoline CAS Name: 3-(benzenesulfonyl)-8-[4-(2-methylpropyl)-1-piperazinyl]quinoline IUPAC Name: 3-(benzenesulfonyl)-8-[4-(2-methylpropyl)piperazin-1-yl]quinoline Traditional Name: 3-besyl-8-(4-isobutylpiperazino)quinoline Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)CN1CCN(CC1)C2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2S/c1-18(2)17-25-11-13-26(14-12-25)22-10-6-7-19-15-21(16-24-23(19)22)29(27,28)20-8-4-3-5-9-20/h3-10,15-16,18H,11-14,17H2,1-2H3