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

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(benzylamino)-3-oxo-propyl]piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-oxo-3-[(phenylmethyl)amino]propyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(benzylamino)-3-oxopropyl]piperidine-4-carboxamide Traditional Name: N-[3-(benzylamino)-3-keto-propyl]-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C22H25N5O4S2 MolecularWeight: 487.595

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O4S2/c28-20(24-15-16-5-2-1-3-6-16)9-12-23-22(29)17-10-13-27(14-11-17)33(30,31)19-8-4-7-18-21(19)26-32-25-18/h1-8,17H,9-15H2,(H,23,29)(H,24,28)