3-[3-[4-[(2-methylsulfonylphenyl)methyl]piperazin-1-yl]propyl]quinoline

Systemtic Name: 3-[3-[4-[(2-methylsulfonylphenyl)methyl]piperazin-1-yl]propyl]quinoline Openeye Name: 3-[3-[4-[(2-methylsulfonylphenyl)methyl]piperazin-1-yl]propyl]quinoline CAS Name: 3-[3-[4-[(2-methylsulfonylphenyl)methyl]-1-piperazinyl]propyl]quinoline IUPAC Name: 3-[3-[4-[(2-methylsulfonylphenyl)methyl]piperazin-1-yl]propyl]quinoline Traditional Name: 3-[3-[4-(2-mesylbenzyl)piperazino]propyl]quinoline Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1CN2CCN(CC2)CCCC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1CN2CCN(CC2)CCCC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C24H29N3O2S/c1-30(28,29)24-11-5-3-9-22(24)19-27-15-13-26(14-16-27)12-6-7-20-17-21-8-2-4-10-23(21)25-18-20/h2-5,8-11,17-18H,6-7,12-16,19H2,1H3