O2-tert-butyl O4-ethyl 5-(dodecanoylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 5-(dodecanoylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 5-(dodecanoylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-(1-oxododecylamino)thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 5-(dodecanoylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(lauroylamino)-3-methyl-thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C25H41NO5S MolecularWeight: 467.66174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H41NO5S/c1-7-9-10-11-12-13-14-15-16-17-19(27)26-22-20(23(28)30-8-2)18(3)21(32-22)24(29)31-25(4,5)6/h7-17H2,1-6H3,(H,26,27)