1,3,5-trimethyl-N-[2-(phenylmethylsulfanyl)phenyl]pyrazole-4-sulfonamide

Systemtic Name: 1,3,5-trimethyl-N-[2-(phenylmethylsulfanyl)phenyl]pyrazole-4-sulfonamide Openeye Name: N-(2-benzylsulfanylphenyl)-1,3,5-trimethyl-pyrazole-4-sulfonamide CAS Name: 1,3,5-trimethyl-N-[2-(phenylmethylthio)phenyl]-4-pyrazolesulfonamide IUPAC Name: N-(2-benzylsulfanylphenyl)-1,3,5-trimethylpyrazole-4-sulfonamide Traditional Name: N-[2-(benzylthio)phenyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide Formula: C19H21N3O2S2 MolecularWeight: 387.51894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)S(=O)(=O)NC2=CC=CC=C2SCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C)C)S(=O)(=O)NC2=CC=CC=C2SCC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2S2/c1-14-19(15(2)22(3)20-14)26(23,24)21-17-11-7-8-12-18(17)25-13-16-9-5-4-6-10-16/h4-12,21H,13H2,1-3H3