diethyl 5-(2,2-dimethylpropanoylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-(2,2-dimethylpropanoylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-(2,2-dimethylpropanoylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(2,2-dimethylpropanoylcarbamothioylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(pivaloylthiocarbamoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C17H24N2O5S2 MolecularWeight: 400.51286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC(=O)C(C)(C)C

InChI

InChI=1S/C17H24N2O5S2/c1-7-23-13(20)10-9(3)11(14(21)24-8-2)26-12(10)18-16(25)19-15(22)17(4,5)6/h7-8H2,1-6H3,(H2,18,19,22,25)