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

Systemtic Name: methyl 4-cyano-3-methyl-5-(2-methylpropanoylamino)thiophene-2-carboxylate Openeye Name: methyl 4-cyano-3-methyl-5-(2-methylpropanoylamino)thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[(2-methyl-1-oxopropyl)amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-3-methyl-5-(2-methylpropanoylamino)thiophene-2-carboxylate Traditional Name: 4-cyano-5-(isobutyrylamino)-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O3S/c1-6(2)10(15)14-11-8(5-13)7(3)9(18-11)12(16)17-4/h6H,1-4H3,(H,14,15)