5-azanyl-1-[6-(2-fluoranylphenoxy)-2-methyl-pyrimidin-4-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[6-(2-fluoranylphenoxy)-2-methyl-pyrimidin-4-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(2-fluorophenoxy)-2-methyl-pyrimidin-4-yl]-3-methylsulfanyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(2-fluorophenoxy)-2-methyl-4-pyrimidinyl]-3-(methylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(2-fluorophenoxy)-2-methylpyrimidin-4-yl]-3-methylsulfanylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(2-fluorophenoxy)-2-methyl-pyrimidin-4-yl]-3-(methylthio)pyrazole-4-carbonitrile Formula: C16H13FN6OS MolecularWeight: 356.377423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)OC2=CC=CC=C2F)N3C(=C(C(=N3)SC)C#N)N

Isomeric SMILES

CC1=NC(=CC(=N1)OC2=CC=CC=C2F)N3C(=C(C(=N3)SC)C#N)N

InChI

InChI=1S/C16H13FN6OS/c1-9-20-13(23-15(19)10(8-18)16(22-23)25-2)7-14(21-9)24-12-6-4-3-5-11(12)17/h3-7H,19H2,1-2H3