ethyl 3-methyl-5-(2-methylpropanoylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-(2-methylpropanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-(2-methylpropanoylamino)thiophene-2-carboxylate CAS Name: 3-methyl-5-[(2-methyl-1-oxopropyl)amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-(2-methylpropanoylamino)thiophene-2-carboxylate Traditional Name: 5-(isobutyrylamino)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C12H17NO3S MolecularWeight: 255.33328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C(C)C)C

InChI

InChI=1S/C12H17NO3S/c1-5-16-12(15)10-8(4)6-9(17-10)13-11(14)7(2)3/h6-7H,5H2,1-4H3,(H,13,14)