methyl 4-cyano-5-(ethanoylcarbamothioylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-(ethanoylcarbamothioylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-(acetylcarbamothioylamino)-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[acetamido(sulfanylidene)methyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(acetylcarbamothioylamino)-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-(acetylthiocarbamoylamino)-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C11H11N3O3S2 MolecularWeight: 297.35334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=S)NC(=O)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=S)NC(=O)C)C(=O)OC

InChI

InChI=1S/C11H11N3O3S2/c1-5-7(4-12)9(14-11(18)13-6(2)15)19-8(5)10(16)17-3/h1-3H3,(H2,13,14,15,18)