3-[(2,5-dimethylphenyl)methylsulfanylmethyl]-7-(4-methylpiperazin-1-yl)carbonyl-3,4-dihydro-1H-quinoxalin-2-one

Systemtic Name: 3-[(2,5-dimethylphenyl)methylsulfanylmethyl]-7-(4-methylpiperazin-1-yl)carbonyl-3,4-dihydro-1H-quinoxalin-2-one Openeye Name: 3-[(2,5-dimethylphenyl)methylsulfanylmethyl]-7-(4-methylpiperazine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one CAS Name: 3-[[(2,5-dimethylphenyl)methylthio]methyl]-7-[(4-methyl-1-piperazinyl)-oxomethyl]-3,4-dihydro-1H-quinoxalin-2-one IUPAC Name: 3-[(2,5-dimethylphenyl)methylsulfanylmethyl]-7-(4-methylpiperazine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Traditional Name: 3-[[(2,5-dimethylbenzyl)thio]methyl]-7-(4-methylpiperazine-1-carbonyl)-3,4-dihydro-1H-quinoxalin-2-one Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O2S/c1-16-4-5-17(2)19(12-16)14-31-15-22-23(29)26-21-13-18(6-7-20(21)25-22)24(30)28-10-8-27(3)9-11-28/h4-7,12-13,22,25H,8-11,14-15H2,1-3H3,(H,26,29)