3-[3-ethoxy-2,6-bis(fluoranyl)phenyl]-7-methylsulfinyl-1-pentan-3-yl-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-[3-ethoxy-2,6-bis(fluoranyl)phenyl]-7-methylsulfinyl-1-pentan-3-yl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 3-(3-ethoxy-2,6-difluoro-phenyl)-1-(1-ethylpropyl)-7-methylsulfinyl-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 3-(3-ethoxy-2,6-difluorophenyl)-7-methylsulfinyl-1-pentan-3-yl-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 3-(3-ethoxy-2,6-difluorophenyl)-7-methylsulfinyl-1-pentan-3-yl-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 3-(3-ethoxy-2,6-difluoro-phenyl)-1-(1-ethylpropyl)-7-methylsulfinyl-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C20H24F2N4O3S MolecularWeight: 438.491366

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC(=C3F)OCC)F)S(=O)C

Isomeric SMILES

CCC(CC)N1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC(=C3F)OCC)F)S(=O)C

InChI

InChI=1S/C20H24F2N4O3S/c1-5-13(6-2)26-18-12(10-23-19(24-18)30(4)28)11-25(20(26)27)17-14(21)8-9-15(16(17)22)29-7-3/h8-10,13H,5-7,11H2,1-4H3