methyl 2-[[1-adamantylcarbonyl(cyclohexyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[1-adamantylcarbonyl(cyclohexyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[adamantane-1-carbonyl(cyclohexyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[1-adamantyl(oxo)methyl]-cyclohexylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[adamantane-1-carbonyl(cyclohexyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[adamantane-1-carbonyl(cyclohexyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C23H32N2O3S MolecularWeight: 416.57678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H32N2O3S/c1-28-21(26)19-14-29-20(24-19)13-25(18-5-3-2-4-6-18)22(27)23-10-15-7-16(11-23)9-17(8-15)12-23/h14-18H,2-13H2,1H3