methyl 2-[[[(2S)-2-ethylhexanoyl]-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[[(2S)-2-ethylhexanoyl]-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[[(2S)-2-ethylhexanoyl]-(2-methoxyethyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(2S)-2-ethyl-1-oxohexyl]-(2-methoxyethyl)amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[[(2S)-2-ethylhexanoyl]-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[[(2S)-2-ethylhexanoyl]-(2-methoxyethyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C17H28N2O4S MolecularWeight: 356.48022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CCOC)CC1=NC(=CS1)C(=O)OC

Isomeric SMILES

CCCC[C@H](CC)C(=O)N(CCOC)CC1=NC(=CS1)C(=O)OC

InChI

InChI=1S/C17H28N2O4S/c1-5-7-8-13(6-2)16(20)19(9-10-22-3)11-15-18-14(12-24-15)17(21)23-4/h12-13H,5-11H2,1-4H3/t13-/m0/s1