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

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-(undecanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-(undecanoylamino)thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-(1-oxoundecylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-(undecanoylamino)thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-(undecanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C21H33NO4S MolecularWeight: 395.55602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)NC1=C(C(=C(S1)C(=O)C)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCC(=O)NC1=C(C(=C(S1)C(=O)C)C)C(=O)OCC

InChI

InChI=1S/C21H33NO4S/c1-5-7-8-9-10-11-12-13-14-17(24)22-20-18(21(25)26-6-2)15(3)19(27-20)16(4)23/h5-14H2,1-4H3,(H,22,24)