ethyl 5-ethanoyl-2-(2-ethylhexanoylamino)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-2-(2-ethylhexanoylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-(2-ethylhexanoylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[(2-ethyl-1-oxohexyl)amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-(2-ethylhexanoylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-(2-ethylhexanoylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H27NO4S MolecularWeight: 353.47628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=C(C(=C(S1)C(=O)C)C)C(=O)OCC

Isomeric SMILES

CCCCC(CC)C(=O)NC1=C(C(=C(S1)C(=O)C)C)C(=O)OCC

InChI

InChI=1S/C18H27NO4S/c1-6-9-10-13(7-2)16(21)19-17-14(18(22)23-8-3)11(4)15(24-17)12(5)20/h13H,6-10H2,1-5H3,(H,19,21)