N-[4-(5-cyano-3-methylsulfonyl-3-thiophen-2-yl-1H-pyrazol-2-yl)phenyl]-N-methyl-methanamide

Systemtic Name: N-[4-(5-cyano-3-methylsulfonyl-3-thiophen-2-yl-1H-pyrazol-2-yl)phenyl]-N-methyl-methanamide Openeye Name: N-[4-[5-cyano-3-methylsulfonyl-3-(2-thienyl)-1H-pyrazol-2-yl]phenyl]-N-methyl-formamide CAS Name: N-[4-(5-cyano-3-methylsulfonyl-3-thiophen-2-yl-1H-pyrazol-2-yl)phenyl]-N-methylformamide IUPAC Name: N-[4-(5-cyano-3-methylsulfonyl-3-thiophen-2-yl-1H-pyrazol-2-yl)phenyl]-N-methylformamide Traditional Name: N-[4-[3-cyano-5-mesyl-5-(2-thienyl)-3-pyrazolin-1-yl]phenyl]-N-methyl-formamide Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

CN(C=O)C1=CC=C(C=C1)N2C(C=C(N2)C#N)(C3=CC=CS3)S(=O)(=O)C

Isomeric SMILES

CN(C=O)C1=CC=C(C=C1)N2C(C=C(N2)C#N)(C3=CC=CS3)S(=O)(=O)C

InChI

InChI=1S/C17H16N4O3S2/c1-20(12-22)14-5-7-15(8-6-14)21-17(26(2,23)24,10-13(11-18)19-21)16-4-3-9-25-16/h3-10,12,19H,1-2H3