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

Systemtic Name: 4-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)-2H-pyrrolo[3,4-d]pyridazin-1-one Openeye Name: 4-isobutyl-6-(1-naphthylmethyl)-2H-pyrrolo[3,4-d]pyridazin-1-one CAS Name: 4-(2-methylpropyl)-6-(1-naphthalenylmethyl)-2H-pyrrolo[3,4-d]pyridazin-1-one IUPAC Name: 4-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)-2H-pyrrolo[3,4-d]pyridazin-1-one Traditional Name: 4-isobutyl-6-(1-naphthylmethyl)-2H-pyrrolo[3,4-d]pyridazin-1-one Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NNC(=O)C2=CN(C=C21)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)CC1=NNC(=O)C2=CN(C=C21)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H21N3O/c1-14(2)10-20-18-12-24(13-19(18)21(25)23-22-20)11-16-8-5-7-15-6-3-4-9-17(15)16/h3-9,12-14H,10-11H2,1-2H3,(H,23,25)