ethyl 2-[[(4-butylphenyl)carbonyl-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(4-butylphenyl)carbonyl-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(4-butylbenzoyl)-(2-methoxyethyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-butylphenyl)-oxomethyl]-(2-methoxyethyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-butylbenzoyl)-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-butylbenzoyl)-(2-methoxyethyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCOC)CC2=NC(=CS2)C(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCOC)CC2=NC(=CS2)C(=O)OCC

InChI

InChI=1S/C21H28N2O4S/c1-4-6-7-16-8-10-17(11-9-16)20(24)23(12-13-26-3)14-19-22-18(15-28-19)21(25)27-5-2/h8-11,15H,4-7,12-14H2,1-3H3