5-methyl-2-(2-methylpropylsulfanyl)-1-(3-phenylpropyl)-6H-imidazo[4,5-d]pyridazine-4,7-dione

Systemtic Name: 5-methyl-2-(2-methylpropylsulfanyl)-1-(3-phenylpropyl)-6H-imidazo[4,5-d]pyridazine-4,7-dione Openeye Name: 2-isobutylsulfanyl-5-methyl-1-(3-phenylpropyl)-6H-imidazo[4,5-d]pyridazine-4,7-dione CAS Name: 5-methyl-2-(2-methylpropylthio)-1-(3-phenylpropyl)-6H-imidazo[4,5-d]pyridazine-4,7-dione IUPAC Name: 5-methyl-2-(2-methylpropylsulfanyl)-1-(3-phenylpropyl)-6H-imidazo[4,5-d]pyridazine-4,7-dione Traditional Name: 2-(isobutylthio)-5-methyl-1-(3-phenylpropyl)-6H-imidazo[4,5-d]pyridazine-4,7-quinone Formula: C19H24N4O2S MolecularWeight: 372.48446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC2=C(N1CCCC3=CC=CC=C3)C(=O)NN(C2=O)C

Isomeric SMILES

CC(C)CSC1=NC2=C(N1CCCC3=CC=CC=C3)C(=O)NN(C2=O)C

InChI

InChI=1S/C19H24N4O2S/c1-13(2)12-26-19-20-15-16(17(24)21-22(3)18(15)25)23(19)11-7-10-14-8-5-4-6-9-14/h4-6,8-9,13H,7,10-12H2,1-3H3,(H,21,24)