5-methylsulfonyl-1-(4-nitrophenyl)-4-thiophen-2-yl-pyrazole-3-carbonitrile

Systemtic Name: 5-methylsulfonyl-1-(4-nitrophenyl)-4-thiophen-2-yl-pyrazole-3-carbonitrile Openeye Name: 5-methylsulfonyl-1-(4-nitrophenyl)-4-(2-thienyl)pyrazole-3-carbonitrile CAS Name: 5-methylsulfonyl-1-(4-nitrophenyl)-4-thiophen-2-yl-3-pyrazolecarbonitrile IUPAC Name: 5-methylsulfonyl-1-(4-nitrophenyl)-4-thiophen-2-ylpyrazole-3-carbonitrile Traditional Name: 5-mesyl-1-(4-nitrophenyl)-4-(2-thienyl)pyrazole-3-carbonitrile Formula: C15H10N4O4S2 MolecularWeight: 374.3943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C#N)C3=CC=CS3

Isomeric SMILES

CS(=O)(=O)C1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C#N)C3=CC=CS3

InChI

InChI=1S/C15H10N4O4S2/c1-25(22,23)15-14(13-3-2-8-24-13)12(9-16)17-18(15)10-4-6-11(7-5-10)19(20)21/h2-8H,1H3