N-(3-chloranyl-4-fluoranyl-phenyl)-2-(2-methylsulfanyl-5-oxidanylidene-pyrimido[4,5-d]pyrimidin-6-yl)ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-(2-methylsulfanyl-5-oxidanylidene-pyrimido[4,5-d]pyrimidin-6-yl)ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-(2-methylsulfanyl-5-oxo-pyrimido[4,5-d]pyrimidin-6-yl)acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-[2-(methylthio)-5-oxo-6-pyrimido[4,5-d]pyrimidinyl]acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-(2-methylsulfanyl-5-oxopyrimido[4,5-d]pyrimidin-6-yl)acetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-[5-keto-2-(methylthio)pyrimido[4,5-d]pyrimidin-6-yl]acetamide Formula: C15H11ClFN5O2S MolecularWeight: 379.796543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C15H11ClFN5O2S/c1-25-15-18-5-9-13(21-15)19-7-22(14(9)24)6-12(23)20-8-2-3-11(17)10(16)4-8/h2-5,7H,6H2,1H3,(H,20,23)