3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,4-dimethoxyphenyl)propanamide

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,4-dimethoxyphenyl)propanamide Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,4-dimethoxyphenyl)propanamide CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,4-dimethoxyphenyl)propanamide IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,4-dimethoxyphenyl)propanamide Traditional Name: N-(3,4-dimethoxyphenyl)-3-piazthiol-4-ylsulfonyl-propionamide Formula: C17H17N3O5S2 MolecularWeight: 407.46398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O5S2/c1-24-13-7-6-11(10-14(13)25-2)18-16(21)8-9-27(22,23)15-5-3-4-12-17(15)20-26-19-12/h3-7,10H,8-9H2,1-2H3,(H,18,21)