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

Systemtic Name: ethyl 5-(diethylcarbamoyl)-4-methyl-2-(undecanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-(diethylcarbamoyl)-4-methyl-2-(undecanoylamino)thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-4-methyl-2-(1-oxoundecylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(diethylcarbamoyl)-4-methyl-2-(undecanoylamino)thiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-4-methyl-2-(undecanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C24H40N2O4S MolecularWeight: 452.6504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H40N2O4S/c1-6-10-11-12-13-14-15-16-17-19(27)25-22-20(24(29)30-9-4)18(5)21(31-22)23(28)26(7-2)8-3/h6-17H2,1-5H3,(H,25,27)