2-butylsulfanyl-3-(3-chloranyl-4-fluoranyl-phenyl)-5,7-dimethyl-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-3-(3-chloranyl-4-fluoranyl-phenyl)-5,7-dimethyl-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 2-butylsulfanyl-3-(3-chloro-4-fluoro-phenyl)-5,7-dimethyl-pyrido[2,3-d]pyrimidin-4-one CAS Name: 2-(butylthio)-3-(3-chloro-4-fluorophenyl)-5,7-dimethyl-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 2-butylsulfanyl-3-(3-chloro-4-fluorophenyl)-5,7-dimethylpyrido[2,3-d]pyrimidin-4-one Traditional Name: 2-(butylthio)-3-(3-chloro-4-fluoro-phenyl)-5,7-dimethyl-pyrido[2,3-d]pyrimidin-4-one Formula: C19H19ClFN3OS MolecularWeight: 391.890063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C(=CC(=N2)C)C)C(=O)N1C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCCCSC1=NC2=C(C(=CC(=N2)C)C)C(=O)N1C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H19ClFN3OS/c1-4-5-8-26-19-23-17-16(11(2)9-12(3)22-17)18(25)24(19)13-6-7-15(21)14(20)10-13/h6-7,9-10H,4-5,8H2,1-3H3