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

Systemtic Name: N-(2-cyanoethyl)-N-phenethyl-1,2,3-benzothiadiazole-4-sulfonamide Openeye Name: N-(2-cyanoethyl)-N-phenethyl-1,2,3-benzothiadiazole-4-sulfonamide CAS Name: N-(2-cyanoethyl)-N-phenethyl-1,2,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-(2-cyanoethyl)-N-phenethyl-1,2,3-benzothiadiazole-4-sulfonamide Traditional Name: N-(2-cyanoethyl)-N-phenethyl-1,2,3-benzothiadiazole-4-sulfonamide Formula: C17H16N4O2S2 MolecularWeight: 372.46454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CCC#N)S(=O)(=O)C2=CC=CC3=C2N=NS3

Isomeric SMILES

C1=CC=C(C=C1)CCN(CCC#N)S(=O)(=O)C2=CC=CC3=C2N=NS3

InChI

InChI=1S/C17H16N4O2S2/c18-11-5-12-21(13-10-14-6-2-1-3-7-14)25(22,23)16-9-4-8-15-17(16)19-20-24-15/h1-4,6-9H,5,10,12-13H2