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

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-(methylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-(methylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[methylamino(sulfanylidene)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-(methylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-(methylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C12H16N2O3S2 MolecularWeight: 300.39704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3S2/c1-5-17-11(16)8-6(2)9(7(3)15)19-10(8)14-12(18)13-4/h5H2,1-4H3,(H2,13,14,18)