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

Systemtic Name: 8-[4-(2,2-dimethylpropyl)piperazin-1-yl]-3-(phenylsulfonyl)quinoline Openeye Name: 3-(benzenesulfonyl)-8-[4-(2,2-dimethylpropyl)piperazin-1-yl]quinoline CAS Name: 3-(benzenesulfonyl)-8-[4-(2,2-dimethylpropyl)-1-piperazinyl]quinoline IUPAC Name: 3-(benzenesulfonyl)-8-[4-(2,2-dimethylpropyl)piperazin-1-yl]quinoline Traditional Name: 3-besyl-8-(4-neopentylpiperazino)quinoline Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O2S/c1-24(2,3)18-26-12-14-27(15-13-26)22-11-7-8-19-16-21(17-25-23(19)22)30(28,29)20-9-5-4-6-10-20/h4-11,16-17H,12-15,18H2,1-3H3