N-(2-cyanoethyl)-N-(3-phenylpropyl)-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-(2-cyanoethyl)-N-(3-phenylpropyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-(2-cyanoethyl)-N-(3-phenylpropyl)-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-(2-cyanoethyl)-N-(3-phenylpropyl)-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-(2-cyanoethyl)-N-(3-phenylpropyl)-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-(2-cyanoethyl)-N-(3-phenylpropyl)piazthiole-4-sulfonamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN(CCC#N)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

C1=CC=C(C=C1)CCCN(CCC#N)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H18N4O2S2/c19-12-6-14-22(13-5-9-15-7-2-1-3-8-15)26(23,24)17-11-4-10-16-18(17)21-25-20-16/h1-4,7-8,10-11H,5-6,9,13-14H2