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

Systemtic Name: 3-[(4-methylphenyl)methylsulfanylmethyl]-7-(4-methylpiperazin-1-yl)carbonyl-3,4-dihydro-1H-quinoxalin-2-one Openeye Name: 7-(4-methylpiperazine-1-carbonyl)-3-(p-tolylmethylsulfanylmethyl)-3,4-dihydro-1H-quinoxalin-2-one CAS Name: 3-[[(4-methylphenyl)methylthio]methyl]-7-[(4-methyl-1-piperazinyl)-oxomethyl]-3,4-dihydro-1H-quinoxalin-2-one IUPAC Name: 3-[(4-methylphenyl)methylsulfanylmethyl]-7-(4-methylpiperazine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Traditional Name: 3-[[(4-methylbenzyl)thio]methyl]-7-(4-methylpiperazine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)N4CCN(CC4)C

InChI

InChI=1S/C23H28N4O2S/c1-16-3-5-17(6-4-16)14-30-15-21-22(28)25-20-13-18(7-8-19(20)24-21)23(29)27-11-9-26(2)10-12-27/h3-8,13,21,24H,9-12,14-15H2,1-2H3,(H,25,28)