5-chloranyl-1,3-dimethyl-N-(2-methylsulfanylphenyl)pyrazole-4-sulfonamide

Systemtic Name: 5-chloranyl-1,3-dimethyl-N-(2-methylsulfanylphenyl)pyrazole-4-sulfonamide Openeye Name: 5-chloro-1,3-dimethyl-N-(2-methylsulfanylphenyl)pyrazole-4-sulfonamide CAS Name: 5-chloro-1,3-dimethyl-N-[2-(methylthio)phenyl]-4-pyrazolesulfonamide IUPAC Name: 5-chloro-1,3-dimethyl-N-(2-methylsulfanylphenyl)pyrazole-4-sulfonamide Traditional Name: 5-chloro-1,3-dimethyl-N-[2-(methylthio)phenyl]pyrazole-4-sulfonamide Formula: C12H14ClN3O2S2 MolecularWeight: 331.84146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)NC2=CC=CC=C2SC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)NC2=CC=CC=C2SC)Cl)C

InChI

InChI=1S/C12H14ClN3O2S2/c1-8-11(12(13)16(2)14-8)20(17,18)15-9-6-4-5-7-10(9)19-3/h4-7,15H,1-3H3