3-bromanyl-4-butoxy-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[[4-[cyclohexyl(methyl)sulfamoyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]thiocarbamoyl]benzamide Formula: C25H32BrN3O4S2 MolecularWeight: 582.57328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N(C)C3CCCCC3)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N(C)C3CCCCC3)Br

InChI

InChI=1S/C25H32BrN3O4S2/c1-3-4-16-33-23-15-10-18(17-22(23)26)24(30)28-25(34)27-19-11-13-21(14-12-19)35(31,32)29(2)20-8-6-5-7-9-20/h10-15,17,20H,3-9,16H2,1-2H3,(H2,27,28,30,34)