2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(2-phenylsulfanylethyl)ethanamide

Systemtic Name: 2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(2-phenylsulfanylethyl)ethanamide Openeye Name: 2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(2-phenylsulfanylethyl)acetamide CAS Name: 2-[[6-(dimethylsulfamoyl)-1-benzotriazolyl]oxy]-N-[2-(phenylthio)ethyl]acetamide IUPAC Name: 2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(2-phenylsulfanylethyl)acetamide Traditional Name: 2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-[2-(phenylthio)ethyl]acetamide Formula: C18H21N5O4S2 MolecularWeight: 435.52044

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCC(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCC(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C18H21N5O4S2/c1-22(2)29(25,26)15-8-9-16-17(12-15)23(21-20-16)27-13-18(24)19-10-11-28-14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3,(H,19,24)