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

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

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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)OC

Isomeric SMILES

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

InChI

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