[(3R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(3R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(3R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-piperidyl]-pyrrolidin-1-yl-methanone CAS Name: [(3R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-piperidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [(3R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(3R)-1-piazthiol-4-ylsulfonyl-3-piperidyl]-pyrrolidino-methanone Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C16H20N4O3S2/c21-16(19-8-1-2-9-19)12-5-4-10-20(11-12)25(22,23)14-7-3-6-13-15(14)18-24-17-13/h3,6-7,12H,1-2,4-5,8-11H2/t12-/m1/s1