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

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-oxidanylidene-3-(3-oxidanylpropylamino)propyl]piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(3-hydroxypropylamino)-3-oxo-propyl]piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(3-hydroxypropylamino)-3-oxopropyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(3-hydroxypropylamino)-3-oxopropyl]piperidine-4-carboxamide Traditional Name: N-[3-(3-hydroxypropylamino)-3-keto-propyl]-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C18H25N5O5S2 MolecularWeight: 455.5516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5O5S2/c24-12-2-8-19-16(25)5-9-20-18(26)13-6-10-23(11-7-13)30(27,28)15-4-1-3-14-17(15)22-29-21-14/h1,3-4,13,24H,2,5-12H2,(H,19,25)(H,20,26)