5-methylsulfonyl-3-phenyl-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-methylsulfonyl-3-phenyl-1H-pyrazole-4-carbonitrile Openeye Name: 5-methylsulfonyl-3-phenyl-1H-pyrazole-4-carbonitrile CAS Name: 5-methylsulfonyl-3-phenyl-1H-pyrazole-4-carbonitrile IUPAC Name: 5-methylsulfonyl-3-phenyl-1H-pyrazole-4-carbonitrile Traditional Name: 5-mesyl-3-phenyl-1H-pyrazole-4-carbonitrile Formula: C11H9N3O2S MolecularWeight: 247.27306

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=NN1)C2=CC=CC=C2)C#N

Isomeric SMILES

CS(=O)(=O)C1=C(C(=NN1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C11H9N3O2S/c1-17(15,16)11-9(7-12)10(13-14-11)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,14)