ethyl 2-[2-(1-adamantylcarbonyloxy)ethanoyl-(phenylmethyl)amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-(1-adamantylcarbonyloxy)ethanoyl-(phenylmethyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-(adamantane-1-carbonyloxy)acetyl]-benzyl-amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[1-adamantyl(oxo)methoxy]-1-oxoethyl]-(phenylmethyl)amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(adamantane-1-carbonyloxy)acetyl]-benzylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(adamantane-1-carbonyloxy)acetyl]-benzyl-amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C27H32N2O5S MolecularWeight: 496.61838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N(CC2=CC=CC=C2)C(=O)COC(=O)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N(CC2=CC=CC=C2)C(=O)COC(=O)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C27H32N2O5S/c1-3-33-24(31)23-17(2)28-26(35-23)29(15-18-7-5-4-6-8-18)22(30)16-34-25(32)27-12-19-9-20(13-27)11-21(10-19)14-27/h4-8,19-21H,3,9-16H2,1-2H3