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

Systemtic Name: 5-azanyl-1-(6-ethoxy-2-methylsulfanyl-pyrimidin-4-yl)-3-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(6-ethoxy-2-methylsulfanyl-pyrimidin-4-yl)-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-ethoxy-2-(methylthio)-4-pyrimidinyl]-3-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(6-ethoxy-2-methylsulfanylpyrimidin-4-yl)-3-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-ethoxy-2-(methylthio)pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Formula: C12H14N6OS MolecularWeight: 290.34416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=C1)N2C(=C(C(=N2)C)C#N)N)SC

Isomeric SMILES

CCOC1=NC(=NC(=C1)N2C(=C(C(=N2)C)C#N)N)SC

InChI

InChI=1S/C12H14N6OS/c1-4-19-10-5-9(15-12(16-10)20-3)18-11(14)8(6-13)7(2)17-18/h5H,4,14H2,1-3H3