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4-azanyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]pyrimidine-5-carbonitrile

4-azanyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name:4-azanyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]pyrimidine-5-carbonitrile
Openeye Name:4-amino-2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]pyrimidine-5-carbonitrile
CAS Name:4-amino-2-[(3-fluoro-4-methoxyphenyl)methylthio]-5-pyrimidinecarbonitrile
IUPAC Name:4-amino-2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]pyrimidine-5-carbonitrile
Traditional Name:4-amino-2-[(3-fluoro-4-methoxy-benzyl)thio]pyrimidine-5-carbonitrile
Formula: C13H11FN4OS
MolecularWeight: 290.316043
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NC=C(C(=N2)N)C#N)F


Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC=C(C(=N2)N)C#N)F


InChI

InChI=1S/C13H11FN4OS/c1-19-11-3-2-8(4-10(11)14)7-20-13-17-6-9(5-15)12(16)18-13/h2-4,6H,7H2,1H3,(H2,16,17,18)


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