ethyl 5-aminocarbonyl-2-(dodecanoylamino)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-(dodecanoylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-2-(dodecanoylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-(1-oxododecylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-2-(dodecanoylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-(lauroylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H34N2O4S MolecularWeight: 410.57066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=C(C(=C(S1)C(=O)N)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=C(C(=C(S1)C(=O)N)C)C(=O)OCC

InChI

InChI=1S/C21H34N2O4S/c1-4-6-7-8-9-10-11-12-13-14-16(24)23-20-17(21(26)27-5-2)15(3)18(28-20)19(22)25/h4-14H2,1-3H3,(H2,22,25)(H,23,24)