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

Systemtic Name: 3-bromanyl-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioyl]-4-hexoxy-benzamide Openeye Name: 3-bromo-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioyl]-4-hexoxy-benzamide CAS Name: 3-bromo-N-[[4-[cyclohexyl(methyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: 3-bromo-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioyl]-4-hexoxybenzamide Traditional Name: 3-bromo-N-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]thiocarbamoyl]-4-hexoxy-benzamide Formula: C27H36BrN3O4S2 MolecularWeight: 610.62644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N(C)C3CCCCC3)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N(C)C3CCCCC3)Br

InChI

InChI=1S/C27H36BrN3O4S2/c1-3-4-5-9-18-35-25-17-12-20(19-24(25)28)26(32)30-27(36)29-21-13-15-23(16-14-21)37(33,34)31(2)22-10-7-6-8-11-22/h12-17,19,22H,3-11,18H2,1-2H3,(H2,29,30,32,36)