N-[methyl-(4-methylphenyl)-oxidanylidene-$l^{6}-sulfanylidene]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[methyl-(4-methylphenyl)-oxidanylidene-$l^{6}-sulfanylidene]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[methyl-oxo-(p-tolyl)-$l^{6}-sulfanylidene]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[methyl-(4-methylphenyl)-oxo-$l^{6}-sulfanylidene]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[methyl-(4-methylphenyl)-oxo-$l^{6}-sulfanylidene]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[keto-methyl-(p-tolyl)persulfuranylidene]piazthiole-4-sulfonamide Formula: C14H13N3O3S3 MolecularWeight: 367.46632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=NS(=O)(=O)C2=CC=CC3=NSN=C32)(=O)C

InChI

InChI=1S/C14H13N3O3S3/c1-10-6-8-11(9-7-10)22(2,18)17-23(19,20)13-5-3-4-12-14(13)16-21-15-12/h3-9H,1-2H3/t22-/m1/s1