ethyl 2-[[1-adamantylcarbonyl(propan-2-yl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[1-adamantylcarbonyl(propan-2-yl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[adamantane-1-carbonyl(isopropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[1-adamantyl(oxo)methyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[adamantane-1-carbonyl(propan-2-yl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[adamantane-1-carbonyl(isopropyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C21H30N2O3S MolecularWeight: 390.5395

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H30N2O3S/c1-4-26-19(24)17-12-27-18(22-17)11-23(13(2)3)20(25)21-8-14-5-15(9-21)7-16(6-14)10-21/h12-16H,4-11H2,1-3H3