1-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(5-methylpiazthiol-4-yl)sulfonylproline Formula: C12H13N3O4S2 MolecularWeight: 327.37932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NSN=C2C=C1)S(=O)(=O)N3CCCC3C(=O)O

Isomeric SMILES

CC1=C(C2=NSN=C2C=C1)S(=O)(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C12H13N3O4S2/c1-7-4-5-8-10(14-20-13-8)11(7)21(18,19)15-6-2-3-9(15)12(16)17/h4-5,9H,2-3,6H2,1H3,(H,16,17)