(7-fluoranyl-2-methyl-quinolin-3-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (7-fluoranyl-2-methyl-quinolin-3-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(7-fluoro-2-methyl-3-quinolyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(7-fluoro-2-methyl-3-quinolinyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(7-fluoro-2-methylquinolin-3-yl)methanone Traditional Name: (4-besylpiperazino)-(7-fluoro-2-methyl-3-quinolyl)methanone Formula: C21H20FN3O3S MolecularWeight: 413.465203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20FN3O3S/c1-15-19(13-16-7-8-17(22)14-20(16)23-15)21(26)24-9-11-25(12-10-24)29(27,28)18-5-3-2-4-6-18/h2-8,13-14H,9-12H2,1H3