N-[2-(hydroxymethyl)-4-methyl-phenyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-(hydroxymethyl)-4-methyl-phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-(hydroxymethyl)-4-methyl-phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-(hydroxymethyl)-4-methylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-(hydroxymethyl)-4-methylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-(4-methyl-2-methylol-phenyl)piazthiole-4-sulfonamide Formula: C14H13N3O3S2 MolecularWeight: 335.40132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC3=NSN=C32)CO

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC3=NSN=C32)CO

InChI

InChI=1S/C14H13N3O3S2/c1-9-5-6-11(10(7-9)8-18)17-22(19,20)13-4-2-3-12-14(13)16-21-15-12/h2-7,17-18H,8H2,1H3