3-methylsulfanyl-1-(6-methylsulfonylpyridin-3-yl)-5-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 3-methylsulfanyl-1-(6-methylsulfonylpyridin-3-yl)-5-phenyl-pyrazole-4-carbonitrile Openeye Name: 3-methylsulfanyl-1-(6-methylsulfonyl-3-pyridyl)-5-phenyl-pyrazole-4-carbonitrile CAS Name: 1-(6-methylsulfonyl-3-pyridinyl)-3-(methylthio)-5-phenyl-4-pyrazolecarbonitrile IUPAC Name: 3-methylsulfanyl-1-(6-methylsulfonylpyridin-3-yl)-5-phenylpyrazole-4-carbonitrile Traditional Name: 1-(6-mesyl-3-pyridyl)-3-(methylthio)-5-phenyl-pyrazole-4-carbonitrile Formula: C17H14N4O2S2 MolecularWeight: 370.44866

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=C1C#N)C2=CC=CC=C2)C3=CN=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CSC1=NN(C(=C1C#N)C2=CC=CC=C2)C3=CN=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H14N4O2S2/c1-24-17-14(10-18)16(12-6-4-3-5-7-12)21(20-17)13-8-9-15(19-11-13)25(2,22)23/h3-9,11H,1-2H3