3-methyl-1-(2-methylpropyl)-6-(phenylmethyl)-5-pyridin-2-ylsulfanyl-pyrrolo[3,4-d]pyridazin-4-one

Systemtic Name: 3-methyl-1-(2-methylpropyl)-6-(phenylmethyl)-5-pyridin-2-ylsulfanyl-pyrrolo[3,4-d]pyridazin-4-one Openeye Name: 6-benzyl-1-isobutyl-3-methyl-5-(2-pyridylsulfanyl)pyrrolo[3,4-d]pyridazin-4-one CAS Name: 3-methyl-1-(2-methylpropyl)-6-(phenylmethyl)-5-(2-pyridinylthio)-4-pyrrolo[3,4-d]pyridazinone IUPAC Name: 6-benzyl-3-methyl-1-(2-methylpropyl)-5-pyridin-2-ylsulfanylpyrrolo[3,4-d]pyridazin-4-one Traditional Name: 6-benzyl-1-isobutyl-3-methyl-5-(2-pyridylthio)pyrrolo[3,4-d]pyridazin-4-one Formula: C23H24N4OS MolecularWeight: 404.52786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN(C(=O)C2=C(N(C=C12)CC3=CC=CC=C3)SC4=CC=CC=N4)C

Isomeric SMILES

CC(C)CC1=NN(C(=O)C2=C(N(C=C12)CC3=CC=CC=C3)SC4=CC=CC=N4)C

InChI

InChI=1S/C23H24N4OS/c1-16(2)13-19-18-15-27(14-17-9-5-4-6-10-17)23(21(18)22(28)26(3)25-19)29-20-11-7-8-12-24-20/h4-12,15-16H,13-14H2,1-3H3