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

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(2-hydroxyethylamino)-3-oxidanylidene-propyl]piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(2-hydroxyethylamino)-3-oxo-propyl]piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(2-hydroxyethylamino)-3-oxopropyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(2-hydroxyethylamino)-3-oxopropyl]piperidine-4-carboxamide Traditional Name: N-[3-(2-hydroxyethylamino)-3-keto-propyl]-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C17H23N5O5S2 MolecularWeight: 441.52502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC(=O)NCCO)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

C1CN(CCC1C(=O)NCCC(=O)NCCO)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C17H23N5O5S2/c23-11-8-18-15(24)4-7-19-17(25)12-5-9-22(10-6-12)29(26,27)14-3-1-2-13-16(14)21-28-20-13/h1-3,12,23H,4-11H2,(H,18,24)(H,19,25)