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

Systemtic Name: ethyl 5-(diethylcarbamoyl)-2-(dodecanoylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-(diethylcarbamoyl)-2-(dodecanoylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-4-methyl-2-(1-oxododecylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(diethylcarbamoyl)-2-(dodecanoylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-(lauroylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H42N2O4S MolecularWeight: 466.67698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H42N2O4S/c1-6-10-11-12-13-14-15-16-17-18-20(28)26-23-21(25(30)31-9-4)19(5)22(32-23)24(29)27(7-2)8-3/h6-18H2,1-5H3,(H,26,28)