3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]carbonyl-4-methoxy-benzenesulfonamide

Systemtic Name: 3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]carbonyl-4-methoxy-benzenesulfonamide Openeye Name: 3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carbonyl]-4-methoxy-benzenesulfonamide CAS Name: 3-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-oxomethyl]-4-methoxybenzenesulfonamide IUPAC Name: 3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carbonyl]-4-methoxybenzenesulfonamide Traditional Name: 4-methoxy-3-(4-piazthiol-4-ylsulfonylpiperazine-1-carbonyl)benzenesulfonamide Formula: C18H19N5O6S3 MolecularWeight: 497.56836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H19N5O6S3/c1-29-15-6-5-12(31(19,25)26)11-13(15)18(24)22-7-9-23(10-8-22)32(27,28)16-4-2-3-14-17(16)21-30-20-14/h2-6,11H,7-10H2,1H3,(H2,19,25,26)