N-[(4-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[(4-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[(4-isopropyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[(4-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[(4-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[(4-isopropyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]piazthiole-4-sulfonamide Formula: C12H14N6O2S3 MolecularWeight: 370.47356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NNC1=S)CNS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CC(C)N1C(=NNC1=S)CNS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C12H14N6O2S3/c1-7(2)18-10(14-15-12(18)21)6-13-23(19,20)9-5-3-4-8-11(9)17-22-16-8/h3-5,7,13H,6H2,1-2H3,(H,15,21)