4-phenyl-3-[2-(3,4,5-trimethoxyphenyl)quinolin-4-yl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-phenyl-3-[2-(3,4,5-trimethoxyphenyl)quinolin-4-yl]-1H-1,2,4-triazol-5-one Openeye Name: 4-phenyl-3-[2-(3,4,5-trimethoxyphenyl)-4-quinolyl]-1H-1,2,4-triazol-5-one CAS Name: 4-phenyl-3-[2-(3,4,5-trimethoxyphenyl)-4-quinolinyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-phenyl-3-[2-(3,4,5-trimethoxyphenyl)quinolin-4-yl]-1H-1,2,4-triazol-5-one Traditional Name: 4-phenyl-3-[2-(3,4,5-trimethoxyphenyl)-4-quinolyl]-1H-1,2,4-triazol-5-one Formula: C26H22N4O4 MolecularWeight: 454.47728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C4=NNC(=O)N4C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C4=NNC(=O)N4C5=CC=CC=C5

InChI

InChI=1S/C26H22N4O4/c1-32-22-13-16(14-23(33-2)24(22)34-3)21-15-19(18-11-7-8-12-20(18)27-21)25-28-29-26(31)30(25)17-9-5-4-6-10-17/h4-15H,1-3H3,(H,29,31)