1-(3,4-dihydro-2H-quinolin-1-yl)-2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[3-(p-tolylmethyl)quinoxalin-2-yl]sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[3-[(4-methylphenyl)methyl]-2-quinoxalinyl]thio]ethanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[3-[(4-methylphenyl)methyl]quinoxalin-2-yl]sulfanylethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[3-(4-methylbenzyl)quinoxalin-2-yl]thio]ethanone Formula: C27H25N3OS MolecularWeight: 439.5719

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NC3=CC=CC=C3N=C2SCC(=O)N4CCCC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NC3=CC=CC=C3N=C2SCC(=O)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C27H25N3OS/c1-19-12-14-20(15-13-19)17-24-27(29-23-10-4-3-9-22(23)28-24)32-18-26(31)30-16-6-8-21-7-2-5-11-25(21)30/h2-5,7,9-15H,6,8,16-18H2,1H3