(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-2-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-2-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-2-carboxylate CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-2-piperidinecarboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-2-carboxylate Traditional Name: 1-piazthiol-4-ylsulfonylpipecolinic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C20H18N6O5S2 MolecularWeight: 486.52412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CCN(C(C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C20H18N6O5S2/c27-19-13-6-1-2-7-14(13)21-24-25(19)12-31-20(28)16-9-3-4-11-26(16)33(29,30)17-10-5-8-15-18(17)23-32-22-15/h1-2,5-8,10,16H,3-4,9,11-12H2