methyl 4-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioylcarbamoyl]benzoate

Systemtic Name: methyl 4-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioylcarbamoyl]benzoate Openeye Name: methyl 4-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioylcarbamoyl]benzoate CAS Name: 4-[[[[4-[cyclohexyl(methyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamothioylcarbamoyl]benzoate Traditional Name: 4-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]thiocarbamoylcarbamoyl]benzoic acid methyl ester Formula: C23H27N3O5S2 MolecularWeight: 489.60758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H27N3O5S2/c1-26(19-6-4-3-5-7-19)33(29,30)20-14-12-18(13-15-20)24-23(32)25-21(27)16-8-10-17(11-9-16)22(28)31-2/h8-15,19H,3-7H2,1-2H3,(H2,24,25,27,32)