3-methyl-1-(2-methylpropyl)-6-(quinolin-2-ylmethyl)pyrrolo[3,4-d]pyridazin-4-one

Systemtic Name: 3-methyl-1-(2-methylpropyl)-6-(quinolin-2-ylmethyl)pyrrolo[3,4-d]pyridazin-4-one Openeye Name: 1-isobutyl-3-methyl-6-(2-quinolylmethyl)pyrrolo[3,4-d]pyridazin-4-one CAS Name: 3-methyl-1-(2-methylpropyl)-6-(2-quinolinylmethyl)-4-pyrrolo[3,4-d]pyridazinone IUPAC Name: 3-methyl-1-(2-methylpropyl)-6-(quinolin-2-ylmethyl)pyrrolo[3,4-d]pyridazin-4-one Traditional Name: 1-isobutyl-3-methyl-6-(2-quinolylmethyl)pyrrolo[3,4-d]pyridazin-4-one Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN(C(=O)C2=CN(C=C21)CC3=NC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC(C)CC1=NN(C(=O)C2=CN(C=C21)CC3=NC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C21H22N4O/c1-14(2)10-20-17-12-25(13-18(17)21(26)24(3)23-20)11-16-9-8-15-6-4-5-7-19(15)22-16/h4-9,12-14H,10-11H2,1-3H3