AC1MG379

diethyl 3-methyl-5-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]carbamothioylamino]thiophene-2,4-dicarboxylate

Also Known As: diethyl 5-(3-(4-(N-mesitylsulfamoyl)phenyl)thioureido)-3-methylthiophene-2,4-dicarboxylate|diethyl 3-methyl-5-[({4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl}carbamothioyl)amino]thiophene-2,4-dicarboxylate|diethyl 3-methyl-5-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]carbamothioylamino]thiophene-2,4-dicarboxylate|ethyl 5-(ethoxycarbonyl)-4-methyl-2-({thioxo[(4-{[(2,4,6-trimethylphenyl)amino ]sulfonyl}phenyl)amino]methyl}amino)thiophene-3-carboxylate

Molecular Formula	C27H31N3O6S3
Molecular Weight	589.1375 g/mol
LogP	5.94488
Topological Polar Surface Area	122.83 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	8
Rotatable Bonds	9
Exact Mass	589.1375
Monoisotopic Mass	589.1375
Heavy Atoms	39
Complexity	1489.1998

Chemical Identifiers

CAS Number	701925-52-2
SMILES	CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3C)C)C