7-[2-(2-methylpropoxy)phenyl]-2-methylsulfanyl-8H-pyrimido[4,5-d]pyrimidin-5-one

Systemtic Name: 7-[2-(2-methylpropoxy)phenyl]-2-methylsulfanyl-8H-pyrimido[4,5-d]pyrimidin-5-one Openeye Name: 7-(2-isobutoxyphenyl)-2-methylsulfanyl-8H-pyrimido[4,5-d]pyrimidin-5-one CAS Name: 7-[2-(2-methylpropoxy)phenyl]-2-(methylthio)-8H-pyrimido[4,5-d]pyrimidin-5-one IUPAC Name: 7-[2-(2-methylpropoxy)phenyl]-2-methylsulfanyl-8H-pyrimido[4,5-d]pyrimidin-5-one Traditional Name: 7-(2-isobutoxyphenyl)-2-(methylthio)-8H-pyrimido[4,5-d]pyrimidin-5-one Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC=C1C2=NC(=O)C3=CN=C(N=C3N2)SC

Isomeric SMILES

CC(C)COC1=CC=CC=C1C2=NC(=O)C3=CN=C(N=C3N2)SC

InChI

InChI=1S/C17H18N4O2S/c1-10(2)9-23-13-7-5-4-6-11(13)14-19-15-12(16(22)20-14)8-18-17(21-15)24-3/h4-8,10H,9H2,1-3H3,(H,18,19,20,21,22)