5-methyl-N-(pyridin-4-ylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: 5-methyl-N-(pyridin-4-ylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: 5-methyl-N-(4-pyridylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: 5-methyl-N-(pyridin-4-ylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: 5-methyl-N-(pyridin-4-ylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: 5-methyl-N-(4-pyridylmethyl)piazthiole-4-sulfonamide Formula: C13H12N4O2S2 MolecularWeight: 320.38998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NSN=C2C=C1)S(=O)(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC1=C(C2=NSN=C2C=C1)S(=O)(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C13H12N4O2S2/c1-9-2-3-11-12(17-20-16-11)13(9)21(18,19)15-8-10-4-6-14-7-5-10/h2-7,15H,8H2,1H3