[4-(diphenylmethyl)piperazin-1-yl]-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-1-yl]-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone CAS Name: [4-(diphenylmethyl)-1-piperazinyl]-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone Traditional Name: (4-benzhydrylpiperazino)-(1-mesyl-3,4-dihydro-2H-quinolin-6-yl)methanone Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

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