6-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]-5,7-dimethyl-3-phenyl-pyrrolo[3,4-d]pyridazin-4-one

Systemtic Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]-5,7-dimethyl-3-phenyl-pyrrolo[3,4-d]pyridazin-4-one Openeye Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butyl]-5,7-dimethyl-3-phenyl-pyrrolo[3,4-d]pyridazin-4-one CAS Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-5,7-dimethyl-3-phenyl-4-pyrrolo[3,4-d]pyridazinone IUPAC Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-5,7-dimethyl-3-phenylpyrrolo[3,4-d]pyridazin-4-one Traditional Name: 6-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyl]-5,7-dimethyl-3-phenyl-pyrrolo[3,4-d]pyridazin-4-one Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=NN(C(=O)C2=C(N1CCCC(=O)N3CCC4=CC=CC=C4C3)C)C5=CC=CC=C5

Isomeric SMILES

CC1=C2C=NN(C(=O)C2=C(N1CCCC(=O)N3CCC4=CC=CC=C4C3)C)C5=CC=CC=C5

InChI

InChI=1S/C27H28N4O2/c1-19-24-17-28-31(23-11-4-3-5-12-23)27(33)26(24)20(2)30(19)15-8-13-25(32)29-16-14-21-9-6-7-10-22(21)18-29/h3-7,9-12,17H,8,13-16,18H2,1-2H3