2-(4-bromanyl-2-methyl-phenoxy)-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenoxy)-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenoxy)-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-bromo-2-methylphenoxy)-N-[[4-(cyclohexylsulfamoyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-2-methylphenoxy)-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-methyl-phenoxy)-N-[[4-(cyclohexylsulfamoyl)phenyl]thiocarbamoyl]acetamide Formula: C22H26BrN3O4S2 MolecularWeight: 540.49354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3CCCCC3

InChI

InChI=1S/C22H26BrN3O4S2/c1-15-13-16(23)7-12-20(15)30-14-21(27)25-22(31)24-17-8-10-19(11-9-17)32(28,29)26-18-5-3-2-4-6-18/h7-13,18,26H,2-6,14H2,1H3,(H2,24,25,27,31)