3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one

Systemtic Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one Openeye Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one CAS Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one IUPAC Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one Traditional Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=NCC(=O)N(N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=NCC(=O)N(N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C21H22N4O4/c1-28-17-10-14-8-9-24(13-15(14)11-18(17)29-2)21(27)20-22-12-19(26)25(23-20)16-6-4-3-5-7-16/h3-7,10-11H,8-9,12-13H2,1-2H3,(H,22,23)