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

Systemtic Name: [4-(3-methylphenyl)piperazin-1-yl]-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone Openeye Name: (1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-[4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [4-(3-methylphenyl)-1-piperazinyl]-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone IUPAC Name: [4-(3-methylphenyl)piperazin-1-yl]-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)methanone Traditional Name: (1-mesyl-3,4-dihydro-2H-quinolin-6-yl)-[4-(m-tolyl)piperazino]methanone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

InChI

InChI=1S/C22H27N3O3S/c1-17-5-3-7-20(15-17)23-11-13-24(14-12-23)22(26)19-8-9-21-18(16-19)6-4-10-25(21)29(2,27)28/h3,5,7-9,15-16H,4,6,10-14H2,1-2H3