2-methyl-1,1,3-tris(oxidanylidene)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2-benzothiazole-6-carboxamide

Systemtic Name: 2-methyl-1,1,3-tris(oxidanylidene)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2-benzothiazole-6-carboxamide Openeye Name: 2-methyl-1,1,3-trioxo-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2-benzothiazole-6-carboxamide CAS Name: 2-methyl-1,1,3-trioxo-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-1,2-benzothiazole-6-carboxamide IUPAC Name: 2-methyl-1,1,3-trioxo-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2-benzothiazole-6-carboxamide Traditional Name: 1,1,3-triketo-2-methyl-N-(4-pyrrolidinosulfonylphenyl)-1,2-benzothiazole-6-carboxamide Formula: C19H19N3O6S2 MolecularWeight: 449.50066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(S1(=O)=O)C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C(=O)C2=C(S1(=O)=O)C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C19H19N3O6S2/c1-21-19(24)16-9-4-13(12-17(16)30(21,27)28)18(23)20-14-5-7-15(8-6-14)29(25,26)22-10-2-3-11-22/h4-9,12H,2-3,10-11H2,1H3,(H,20,23)