2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-5-chloranyl-N-(2-cyanoethyl)-N-cyclohexyl-benzamide

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-5-chloranyl-N-(2-cyanoethyl)-N-cyclohexyl-benzamide Openeye Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-5-chloro-N-(2-cyanoethyl)-N-cyclohexyl-benzamide CAS Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-5-chloro-N-(2-cyanoethyl)-N-cyclohexylbenzamide IUPAC Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-5-chloro-N-(2-cyanoethyl)-N-cyclohexylbenzamide Traditional Name: 5-chloro-N-(2-cyanoethyl)-N-cyclohexyl-2-(piazthiol-4-ylsulfonylamino)benzamide Formula: C22H22ClN5O3S2 MolecularWeight: 504.02478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CCC#N)C(=O)C2=C(C=CC(=C2)Cl)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CCC(CC1)N(CCC#N)C(=O)C2=C(C=CC(=C2)Cl)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C22H22ClN5O3S2/c23-15-10-11-18(27-33(30,31)20-9-4-8-19-21(20)26-32-25-19)17(14-15)22(29)28(13-5-12-24)16-6-2-1-3-7-16/h4,8-11,14,16,27H,1-3,5-7,13H2