ethyl 5-ethanoyl-2-(ethylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-2-(ethylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-(ethylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[ethylamino(sulfanylidene)methyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-(ethylcarbamothioylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-(ethylthiocarbamoylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C13H18N2O3S2 MolecularWeight: 314.42362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=C(C(=C(S1)C(=O)C)C)C(=O)OCC

Isomeric SMILES

CCNC(=S)NC1=C(C(=C(S1)C(=O)C)C)C(=O)OCC

InChI

InChI=1S/C13H18N2O3S2/c1-5-14-13(19)15-11-9(12(17)18-6-2)7(3)10(20-11)8(4)16/h5-6H2,1-4H3,(H2,14,15,19)