3-[(4-fluorophenyl)methylsulfanylmethyl]-7-(4-methylpiperazin-1-yl)carbonyl-3,4-dihydro-1H-quinoxalin-2-one

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanylmethyl]-7-(4-methylpiperazin-1-yl)carbonyl-3,4-dihydro-1H-quinoxalin-2-one Openeye Name: 3-[(4-fluorophenyl)methylsulfanylmethyl]-7-(4-methylpiperazine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one CAS Name: 3-[[(4-fluorophenyl)methylthio]methyl]-7-[(4-methyl-1-piperazinyl)-oxomethyl]-3,4-dihydro-1H-quinoxalin-2-one IUPAC Name: 3-[(4-fluorophenyl)methylsulfanylmethyl]-7-(4-methylpiperazine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Traditional Name: 3-[[(4-fluorobenzyl)thio]methyl]-7-(4-methylpiperazine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Formula: C22H25FN4O2S MolecularWeight: 428.522903

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CSCC4=CC=C(C=C4)F

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC3=C(C=C2)NC(C(=O)N3)CSCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H25FN4O2S/c1-26-8-10-27(11-9-26)22(29)16-4-7-18-19(12-16)25-21(28)20(24-18)14-30-13-15-2-5-17(23)6-3-15/h2-7,12,20,24H,8-11,13-14H2,1H3,(H,25,28)