(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C26H24N4O3/c1-32-22-15-19-13-14-29(17-20(19)16-23(22)33-2)26(31)24-27-25(18-9-5-3-6-10-18)30(28-24)21-11-7-4-8-12-21/h3-12,15-16H,13-14,17H2,1-2H3