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

Systemtic Name: 3-methyl-1-(2-methylpropyl)-6-(phenylmethyl)pyrrolo[3,4-d]pyridazin-4-one Openeye Name: 6-benzyl-1-isobutyl-3-methyl-pyrrolo[3,4-d]pyridazin-4-one CAS Name: 3-methyl-1-(2-methylpropyl)-6-(phenylmethyl)-4-pyrrolo[3,4-d]pyridazinone IUPAC Name: 6-benzyl-3-methyl-1-(2-methylpropyl)pyrrolo[3,4-d]pyridazin-4-one Traditional Name: 6-benzyl-1-isobutyl-3-methyl-pyrrolo[3,4-d]pyridazin-4-one Formula: C18H21N3O MolecularWeight: 295.37884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O/c1-13(2)9-17-15-11-21(10-14-7-5-4-6-8-14)12-16(15)18(22)20(3)19-17/h4-8,11-13H,9-10H2,1-3H3