3-[[4-ethyl-5-[2-(4-methylphenyl)quinolin-4-yl]-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one

Systemtic Name: 3-[[4-ethyl-5-[2-(4-methylphenyl)quinolin-4-yl]-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Openeye Name: 3-[[4-ethyl-5-[2-(p-tolyl)-4-quinolyl]-1,2,4-triazol-3-yl]sulfanyl]tetrahydrofuran-2-one CAS Name: 3-[[4-ethyl-5-[2-(4-methylphenyl)-4-quinolinyl]-1,2,4-triazol-3-yl]thio]-2-oxolanone IUPAC Name: 3-[[4-ethyl-5-[2-(4-methylphenyl)quinolin-4-yl]-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Traditional Name: 3-[[4-ethyl-5-[2-(p-tolyl)-4-quinolyl]-1,2,4-triazol-3-yl]thio]tetrahydrofuran-2-one Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2CCOC2=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C

Isomeric SMILES

CCN1C(=NN=C1SC2CCOC2=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C

InChI

InChI=1S/C24H22N4O2S/c1-3-28-22(26-27-24(28)31-21-12-13-30-23(21)29)18-14-20(16-10-8-15(2)9-11-16)25-19-7-5-4-6-17(18)19/h4-11,14,21H,3,12-13H2,1-2H3