5-(diethoxymethyl)-1-(1-methyl-5-methylsulfanyl-pyrazol-3-yl)pyrazole-4-carbonitrile

Systemtic Name: 5-(diethoxymethyl)-1-(1-methyl-5-methylsulfanyl-pyrazol-3-yl)pyrazole-4-carbonitrile Openeye Name: 5-(diethoxymethyl)-1-(1-methyl-5-methylsulfanyl-pyrazol-3-yl)pyrazole-4-carbonitrile CAS Name: 5-(diethoxymethyl)-1-[1-methyl-5-(methylthio)-3-pyrazolyl]-4-pyrazolecarbonitrile IUPAC Name: 5-(diethoxymethyl)-1-(1-methyl-5-methylsulfanylpyrazol-3-yl)pyrazole-4-carbonitrile Traditional Name: 5-(diethoxymethyl)-1-[1-methyl-5-(methylthio)pyrazol-3-yl]pyrazole-4-carbonitrile Formula: C14H19N5O2S MolecularWeight: 321.39796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C(C=NN1C2=NN(C(=C2)SC)C)C#N)OCC

Isomeric SMILES

CCOC(C1=C(C=NN1C2=NN(C(=C2)SC)C)C#N)OCC

InChI

InChI=1S/C14H19N5O2S/c1-5-20-14(21-6-2)13-10(8-15)9-16-19(13)11-7-12(22-4)18(3)17-11/h7,9,14H,5-6H2,1-4H3