2-pyrrolidin-1-ylethyl 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-4-carboxylate

Systemtic Name: 2-pyrrolidin-1-ylethyl 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-4-carboxylate Openeye Name: 2-pyrrolidin-1-ylethyl 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-piperidinecarboxylic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 2-pyrrolidin-1-ylethyl 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-4-carboxylate Traditional Name: 1-piazthiol-4-ylsulfonylisonipecotic acid 2-pyrrolidinoethyl ester Formula: C18H24N4O4S2 MolecularWeight: 424.53756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CCN(C1)CCOC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H24N4O4S2/c23-18(26-13-12-21-8-1-2-9-21)14-6-10-22(11-7-14)28(24,25)16-5-3-4-15-17(16)20-27-19-15/h3-5,14H,1-2,6-13H2