ethyl 5-(butanoylamino)-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-(butanoylamino)-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-(butanoylamino)-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-(1-oxobutylamino)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(butanoylamino)-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-butyramido-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C#N

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C#N

InChI

InChI=1S/C13H16N2O3S/c1-4-6-10(16)15-12-9(7-14)8(3)11(19-12)13(17)18-5-2/h4-6H2,1-3H3,(H,15,16)