N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)methanesulfonamide

Systemtic Name: N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)methanesulfonamide Openeye Name: N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)methanesulfonamide CAS Name: N-[4-cyano-5-(ethylthio)-1-phenyl-3-pyrazolyl]methanesulfonamide IUPAC Name: N-(4-cyano-5-ethylsulfanyl-1-phenylpyrazol-3-yl)methanesulfonamide Traditional Name: N-[4-cyano-5-(ethylthio)-1-phenyl-pyrazol-3-yl]methanesulfonamide Formula: C13H14N4O2S2 MolecularWeight: 322.40586

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=NN1C2=CC=CC=C2)NS(=O)(=O)C)C#N

Isomeric SMILES

CCSC1=C(C(=NN1C2=CC=CC=C2)NS(=O)(=O)C)C#N

InChI

InChI=1S/C13H14N4O2S2/c1-3-20-13-11(9-14)12(16-21(2,18)19)15-17(13)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H,15,16)