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

Systemtic Name: methyl 2-[[cyclohexyl(2-phenylmethoxyethanoyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(2-benzyloxyacetyl)-cyclohexyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclohexyl-(1-oxo-2-phenylmethoxyethyl)amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[cyclohexyl-(2-phenylmethoxyacetyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(2-benzoxyacetyl)-cyclohexyl-amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)COCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)COCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c1-26-21(25)18-15-28-19(22-18)12-23(17-10-6-3-7-11-17)20(24)14-27-13-16-8-4-2-5-9-16/h2,4-5,8-9,15,17H,3,6-7,10-14H2,1H3