8-[(2S)-butan-2-yl]-4-(4-fluoranyl-2-methyl-phenyl)-2-methylsulfanyl-pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-[(2S)-butan-2-yl]-4-(4-fluoranyl-2-methyl-phenyl)-2-methylsulfanyl-pyrido[2,3-d]pyrimidin-7-one Openeye Name: 4-(4-fluoro-2-methyl-phenyl)-8-[(1S)-1-methylpropyl]-2-methylsulfanyl-pyrido[2,3-d]pyrimidin-7-one CAS Name: 8-[(2S)-butan-2-yl]-4-(4-fluoro-2-methylphenyl)-2-(methylthio)-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 8-[(2S)-butan-2-yl]-4-(4-fluoro-2-methylphenyl)-2-methylsulfanylpyrido[2,3-d]pyrimidin-7-one Traditional Name: 4-(4-fluoro-2-methyl-phenyl)-8-[(1S)-1-methylpropyl]-2-(methylthio)pyrido[2,3-d]pyrimidin-7-one Formula: C19H20FN3OS MolecularWeight: 357.445003

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C=CC2=C(N=C(N=C21)SC)C3=C(C=C(C=C3)F)C

Isomeric SMILES

CC[C@H](C)N1C(=O)C=CC2=C(N=C(N=C21)SC)C3=C(C=C(C=C3)F)C

InChI

InChI=1S/C19H20FN3OS/c1-5-12(3)23-16(24)9-8-15-17(21-19(25-4)22-18(15)23)14-7-6-13(20)10-11(14)2/h6-10,12H,5H2,1-4H3/t12-/m0/s1