5-methylsulfonyl-3-thiophen-2-yl-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-methylsulfonyl-3-thiophen-2-yl-1H-pyrazole-4-carbonitrile Openeye Name: 5-methylsulfonyl-3-(2-thienyl)-1H-pyrazole-4-carbonitrile CAS Name: 5-methylsulfonyl-3-thiophen-2-yl-1H-pyrazole-4-carbonitrile IUPAC Name: 5-methylsulfonyl-3-thiophen-2-yl-1H-pyrazole-4-carbonitrile Traditional Name: 5-mesyl-3-(2-thienyl)-1H-pyrazole-4-carbonitrile Formula: C9H7N3O2S2 MolecularWeight: 253.30078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=NN1)C2=CC=CS2)C#N

Isomeric SMILES

CS(=O)(=O)C1=C(C(=NN1)C2=CC=CS2)C#N

InChI

InChI=1S/C9H7N3O2S2/c1-16(13,14)9-6(5-10)8(11-12-9)7-3-2-4-15-7/h2-4H,1H3,(H,11,12)