3,4-dihydro-2H-quinolin-1-yl-[3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]methanone

Systemtic Name: 3,4-dihydro-2H-quinolin-1-yl-[3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]methanone Openeye Name: 3,4-dihydro-2H-quinolin-1-yl-[3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]phenyl]methanone CAS Name: 3,4-dihydro-2H-quinolin-1-yl-[3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]phenyl]methanone IUPAC Name: 3,4-dihydro-2H-quinolin-1-yl-[3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]methanone Traditional Name: 3,4-dihydro-2H-quinolin-1-yl-[3-[(4-tosylpiperazino)methyl]phenyl]methanone Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)N4CCCC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C28H31N3O3S/c1-22-11-13-26(14-12-22)35(33,34)30-18-16-29(17-19-30)21-23-6-4-8-25(20-23)28(32)31-15-5-9-24-7-2-3-10-27(24)31/h2-4,6-8,10-14,20H,5,9,15-19,21H2,1H3