ethyl 2-[[2-(4-methoxyphenyl)ethanoyl-(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[2-(4-methoxyphenyl)ethanoyl-(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[isopentyl-[2-(4-methoxyphenyl)acetyl]amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[2-(4-methoxyphenyl)-1-oxoethyl]-(3-methylbutyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[[2-(4-methoxyphenyl)acetyl]-(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[isoamyl-[2-(4-methoxyphenyl)acetyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(CCC(C)C)C(=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(CCC(C)C)C(=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H28N2O4S/c1-5-27-21(25)18-14-28-19(22-18)13-23(11-10-15(2)3)20(24)12-16-6-8-17(26-4)9-7-16/h6-9,14-15H,5,10-13H2,1-4H3