N-[2-(3,4-dimethoxyphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-homoveratrylpiazthiole-4-sulfonamide Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=CC3=NSN=C32)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=CC3=NSN=C32)OC

InChI

InChI=1S/C16H17N3O4S2/c1-22-13-7-6-11(10-14(13)23-2)8-9-17-25(20,21)15-5-3-4-12-16(15)19-24-18-12/h3-7,10,17H,8-9H2,1-2H3