1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-cyanoethyl)-N-methyl-piperidine-4-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-cyanoethyl)-N-methyl-piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-cyanoethyl)-N-methyl-piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-cyanoethyl)-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(2-cyanoethyl)-N-methylpiperidine-4-carboxamide Traditional Name: N-(2-cyanoethyl)-N-methyl-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C16H19N5O3S2 MolecularWeight: 393.48376

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CN(CCC#N)C(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C16H19N5O3S2/c1-20(9-3-8-17)16(22)12-6-10-21(11-7-12)26(23,24)14-5-2-4-13-15(14)19-25-18-13/h2,4-5,12H,3,6-7,9-11H2,1H3