2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=O)N=C(N2)SCC3=CC(=C(C=C3)OC)F)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=O)N=C(N2)SCC3=CC(=C(C=C3)OC)F)C

InChI

InChI=1S/C17H16FN3O2S/c1-9-6-10(2)19-15-14(9)16(22)21-17(20-15)24-8-11-4-5-13(23-3)12(18)7-11/h4-7H,8H2,1-3H3,(H,19,20,21,22)