ethyl 4,5-dimethyl-2-(propan-2-ylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-(propan-2-ylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 2-(isopropylcarbamothioylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[(propan-2-ylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-(propan-2-ylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 2-(isopropylthiocarbamoylamino)-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C13H20N2O2S2 MolecularWeight: 300.4401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O2S2/c1-6-17-12(16)10-8(4)9(5)19-11(10)15-13(18)14-7(2)3/h7H,6H2,1-5H3,(H2,14,15,18)