6-methylsulfanyl-N-[3-(trifluoromethyloxy)phenyl]pyrimido[5,4-d]pyrimidin-4-amine

Systemtic Name: 6-methylsulfanyl-N-[3-(trifluoromethyloxy)phenyl]pyrimido[5,4-d]pyrimidin-4-amine Openeye Name: 6-methylsulfanyl-N-[3-(trifluoromethoxy)phenyl]pyrimido[5,4-d]pyrimidin-4-amine CAS Name: 6-(methylthio)-N-[3-(trifluoromethoxy)phenyl]-4-pyrimido[5,4-d]pyrimidinamine IUPAC Name: 6-methylsulfanyl-N-[3-(trifluoromethoxy)phenyl]pyrimido[5,4-d]pyrimidin-4-amine Traditional Name: [6-(methylthio)pyrimido[5,4-d]pyrimidin-4-yl]-[3-(trifluoromethoxy)phenyl]amine Formula: C14H10F3N5OS MolecularWeight: 353.32231

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C2C(=N1)C(=NC=N2)NC3=CC(=CC=C3)OC(F)(F)F

Isomeric SMILES

CSC1=NC=C2C(=N1)C(=NC=N2)NC3=CC(=CC=C3)OC(F)(F)F

InChI

InChI=1S/C14H10F3N5OS/c1-24-13-18-6-10-11(22-13)12(20-7-19-10)21-8-3-2-4-9(5-8)23-14(15,16)17/h2-7H,1H3,(H,19,20,21)