methyl 2-[2-[2-(1-adamantylcarbonylamino)ethanoyloxy]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[2-(1-adamantylcarbonylamino)ethanoyloxy]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[2-(adamantane-1-carbonylamino)acetyl]oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[2-[[1-adamantyl(oxo)methyl]amino]-1-oxoethoxy]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[2-(adamantane-1-carbonylamino)acetyl]oxyacetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[2-(adamantane-1-carbonylamino)acetyl]oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C23H30N2O6S/c1-12-13(2)32-20(19(12)21(28)30-3)25-17(26)11-31-18(27)10-24-22(29)23-7-14-4-15(8-23)6-16(5-14)9-23/h14-16H,4-11H2,1-3H3,(H,24,29)(H,25,26)