1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-oxidanylidene-3-(pyridin-3-ylmethylamino)propyl]piperidine-4-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-oxidanylidene-3-(pyridin-3-ylmethylamino)propyl]piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-oxo-3-(3-pyridylmethylamino)propyl]piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-oxo-3-(3-pyridinylmethylamino)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-oxo-3-(pyridin-3-ylmethylamino)propyl]piperidine-4-carboxamide Traditional Name: N-[3-keto-3-(3-pyridylmethylamino)propyl]-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C21H24N6O4S2 MolecularWeight: 488.58306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CN(CCC1C(=O)NCCC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H24N6O4S2/c28-19(24-14-15-3-2-9-22-13-15)6-10-23-21(29)16-7-11-27(12-8-16)33(30,31)18-5-1-4-17-20(18)26-32-25-17/h1-5,9,13,16H,6-8,10-12,14H2,(H,23,29)(H,24,28)