ethyl 5-[2,2-bis(chloranyl)ethanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2,2-bis(chloranyl)ethanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[(2,2-dichloroacetyl)amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[(2,2-dichloro-1-oxoethyl)amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[(2,2-dichloroacetyl)amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[(2,2-dichloroacetyl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C11H10Cl2N2O3S MolecularWeight: 321.1797

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(Cl)Cl)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(Cl)Cl)C#N)C

InChI

InChI=1S/C11H10Cl2N2O3S/c1-3-18-11(17)7-5(2)6(4-14)10(19-7)15-9(16)8(12)13/h8H,3H2,1-2H3,(H,15,16)