ethyl 4-ethyl-5-methyl-2-[2-[(3-oxidanyl-1-adamantyl)carbonyloxy]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-[(3-oxidanyl-1-adamantyl)carbonyloxy]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-2-[[2-(3-hydroxyadamantane-1-carbonyl)oxyacetyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-2-[[2-[(3-hydroxy-1-adamantyl)-oxomethoxy]-1-oxoethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-[[2-(3-hydroxyadamantane-1-carbonyl)oxyacetyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-ethyl-2-[[2-(3-hydroxyadamantane-1-carbonyl)oxyacetyl]amino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H31NO6S MolecularWeight: 449.56034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)O)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)O)C

InChI

InChI=1S/C23H31NO6S/c1-4-16-13(3)31-19(18(16)20(26)29-5-2)24-17(25)11-30-21(27)22-7-14-6-15(8-22)10-23(28,9-14)12-22/h14-15,28H,4-12H2,1-3H3,(H,24,25)