2-(8-fluoranyl-6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(8-fluoranyl-6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(8-fluoro-6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-(8-fluoro-6-methyl-3,4-dihydro-2H-quinolin-1-yl)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(8-fluoro-6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(8-fluoro-6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C23H28FN3O3S MolecularWeight: 445.550123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)CCCN2CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)F

Isomeric SMILES

CC1=CC(=C2C(=C1)CCCN2CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)F

InChI

InChI=1S/C23H28FN3O3S/c1-18-14-20-8-5-9-26(23(20)21(24)15-18)16-22(28)25-10-12-27(13-11-25)31(29,30)17-19-6-3-2-4-7-19/h2-4,6-7,14-15H,5,8-13,16-17H2,1H3