N-[2-[4-(2-methoxyethoxy)-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]cyclohexene-1-carboxamide

Systemtic Name: N-[2-[4-(2-methoxyethoxy)-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]cyclohexene-1-carboxamide Openeye Name: N-[2-[4-(2-methoxyethoxy)-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]cyclohexene-1-carboxamide CAS Name: N-[2-[4-(2-methoxyethoxy)-3-[[methylamino(sulfanylidene)methyl]sulfamoyl]phenyl]ethyl]-1-cyclohexenecarboxamide IUPAC Name: N-[2-[4-(2-methoxyethoxy)-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]cyclohexene-1-carboxamide Traditional Name: N-[2-[4-(2-methoxyethoxy)-3-(methylthiocarbamoylsulfamoyl)phenyl]ethyl]cyclohexene-1-carboxamide Formula: C20H29N3O5S2 MolecularWeight: 455.59136

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C2=CCCCC2)OCCOC

Isomeric SMILES

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C2=CCCCC2)OCCOC

InChI

InChI=1S/C20H29N3O5S2/c1-21-20(29)23-30(25,26)18-14-15(8-9-17(18)28-13-12-27-2)10-11-22-19(24)16-6-4-3-5-7-16/h6,8-9,14H,3-5,7,10-13H2,1-2H3,(H,22,24)(H2,21,23,29)