3-azanyl-1-(5-methylsulfonylpyridin-2-yl)-5-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-1-(5-methylsulfonylpyridin-2-yl)-5-phenyl-pyrazole-4-carbonitrile Openeye Name: 3-amino-1-(5-methylsulfonyl-2-pyridyl)-5-phenyl-pyrazole-4-carbonitrile CAS Name: 3-amino-1-(5-methylsulfonyl-2-pyridinyl)-5-phenyl-4-pyrazolecarbonitrile IUPAC Name: 3-amino-1-(5-methylsulfonylpyridin-2-yl)-5-phenylpyrazole-4-carbonitrile Traditional Name: 3-amino-1-(5-mesyl-2-pyridyl)-5-phenyl-pyrazole-4-carbonitrile Formula: C16H13N5O2S MolecularWeight: 339.37172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)N)C#N)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C16H13N5O2S/c1-24(22,23)12-7-8-14(19-10-12)21-15(11-5-3-2-4-6-11)13(9-17)16(18)20-21/h2-8,10H,1H3,(H2,18,20)