ethyl 2-(2-dodecylsulfanylethanoylamino)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-(2-dodecylsulfanylethanoylamino)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(2-dodecylsulfanylacetyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-(dodecylthio)-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-dodecylsulfanylacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(laurylthio)acetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H36N2O3S2 MolecularWeight: 428.65214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC(=O)NC1=NC(=C(S1)C(=O)OCC)C

Isomeric SMILES

CCCCCCCCCCCCSCC(=O)NC1=NC(=C(S1)C(=O)OCC)C

InChI

InChI=1S/C21H36N2O3S2/c1-4-6-7-8-9-10-11-12-13-14-15-27-16-18(24)23-21-22-17(3)19(28-21)20(25)26-5-2/h4-16H2,1-3H3,(H,22,23,24)