2-[(2-azanyl-5-fluoranyl-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2-azanyl-5-fluoranyl-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(2-amino-5-fluoro-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[(2-amino-5-fluorophenyl)methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2-amino-5-fluorophenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(2-amino-5-fluoro-benzyl)thio]-6-propyl-1H-pyrimidin-4-one Formula: C14H16FN3OS MolecularWeight: 293.359743

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=C(C=CC(=C2)F)N

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=C(C=CC(=C2)F)N

InChI

InChI=1S/C14H16FN3OS/c1-2-3-11-7-13(19)18-14(17-11)20-8-9-6-10(15)4-5-12(9)16/h4-7H,2-3,8,16H2,1H3,(H,17,18,19)