6-methyl-5-(1-methyl-6-oxidanylidene-pyridazin-3-yl)oxy-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-(1-methyl-6-oxidanylidene-pyridazin-3-yl)oxy-2-(phenylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-6-methyl-5-(1-methyl-6-oxo-pyridazin-3-yl)oxy-1H-pyrimidin-4-one CAS Name: 6-methyl-5-[(1-methyl-6-oxo-3-pyridazinyl)oxy]-2-(phenylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 2-benzylsulfanyl-6-methyl-5-(1-methyl-6-oxopyridazin-3-yl)oxy-1H-pyrimidin-4-one Traditional Name: 2-(benzylthio)-5-(6-keto-1-methyl-pyridazin-3-yl)oxy-6-methyl-1H-pyrimidin-4-one Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)OC3=NN(C(=O)C=C3)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)OC3=NN(C(=O)C=C3)C

InChI

InChI=1S/C17H16N4O3S/c1-11-15(24-13-8-9-14(22)21(2)20-13)16(23)19-17(18-11)25-10-12-6-4-3-5-7-12/h3-9H,10H2,1-2H3,(H,18,19,23)