N-[[2-chloranyl-5-(diethylsulfamoyl)phenyl]carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[[2-chloranyl-5-(diethylsulfamoyl)phenyl]carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[[2-chloro-5-(diethylsulfamoyl)phenyl]carbamothioyl]adamantane-1-carboxamide CAS Name: N-[[2-chloro-5-(diethylsulfamoyl)anilino]-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[[2-chloro-5-(diethylsulfamoyl)phenyl]carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[[2-chloro-5-(diethylsulfamoyl)phenyl]thiocarbamoyl]adamantane-1-carboxamide Formula: C22H30ClN3O3S2 MolecularWeight: 484.0749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H30ClN3O3S2/c1-3-26(4-2)31(28,29)17-5-6-18(23)19(10-17)24-21(30)25-20(27)22-11-14-7-15(12-22)9-16(8-14)13-22/h5-6,10,14-16H,3-4,7-9,11-13H2,1-2H3,(H2,24,25,27,30)