3-tert-butyl-1-methyl-7-methylsulfanyl-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-tert-butyl-1-methyl-7-methylsulfanyl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 3-tert-butyl-1-methyl-7-methylsulfanyl-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 3-tert-butyl-1-methyl-7-(methylthio)-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 3-tert-butyl-1-methyl-7-methylsulfanyl-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 3-tert-butyl-1-methyl-7-(methylthio)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C12H18N4OS MolecularWeight: 266.36252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC2=CN=C(N=C2N(C1=O)C)SC

Isomeric SMILES

CC(C)(C)N1CC2=CN=C(N=C2N(C1=O)C)SC

InChI

InChI=1S/C12H18N4OS/c1-12(2,3)16-7-8-6-13-10(18-5)14-9(8)15(4)11(16)17/h6H,7H2,1-5H3