7-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-3-[(3-methylphenyl)methylsulfonylmethyl]-3,4-dihydro-1H-quinoxalin-2-one

Systemtic Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-3-[(3-methylphenyl)methylsulfonylmethyl]-3,4-dihydro-1H-quinoxalin-2-one Openeye Name: 7-[4-(4-fluorophenyl)piperazine-1-carbonyl]-3-(m-tolylmethylsulfonylmethyl)-3,4-dihydro-1H-quinoxalin-2-one CAS Name: 7-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-3-[(3-methylphenyl)methylsulfonylmethyl]-3,4-dihydro-1H-quinoxalin-2-one IUPAC Name: 7-[4-(4-fluorophenyl)piperazine-1-carbonyl]-3-[(3-methylphenyl)methylsulfonylmethyl]-3,4-dihydro-1H-quinoxalin-2-one Traditional Name: 7-[4-(4-fluorophenyl)piperazine-1-carbonyl]-3-[(3-methylbenzyl)sulfonylmethyl]-3,4-dihydro-1H-quinoxalin-2-one Formula: C28H29FN4O4S MolecularWeight: 536.617663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)CC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)CC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H29FN4O4S/c1-19-3-2-4-20(15-19)17-38(36,37)18-26-27(34)31-25-16-21(5-10-24(25)30-26)28(35)33-13-11-32(12-14-33)23-8-6-22(29)7-9-23/h2-10,15-16,26,30H,11-14,17-18H2,1H3,(H,31,34)