N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]piazthiole-4-sulfonamide Formula: C22H17N5O2S2 MolecularWeight: 447.53268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNS(=O)(=O)C3=CC=CC4=NSN=C43)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNS(=O)(=O)C3=CC=CC4=NSN=C43)C5=CC=CC=C5

InChI

InChI=1S/C22H17N5O2S2/c28-31(29,20-13-7-12-19-22(20)26-30-25-19)23-14-17-15-27(18-10-5-2-6-11-18)24-21(17)16-8-3-1-4-9-16/h1-13,15,23H,14H2