N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanyl]acetamide CAS Name: N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-1,3-benzoxazol-2-yl]thio]acetamide IUPAC Name: N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanoethyl)-2-[[5-(diethylsulfamoyl)-1,3-benzoxazol-2-yl]thio]acetamide Formula: C16H20N4O4S2 MolecularWeight: 396.4844

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)NCCC#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)NCCC#N

InChI

InChI=1S/C16H20N4O4S2/c1-3-20(4-2)26(22,23)12-6-7-14-13(10-12)19-16(24-14)25-11-15(21)18-9-5-8-17/h6-7,10H,3-5,9,11H2,1-2H3,(H,18,21)