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

Systemtic Name: ethyl 2-[[2,2-diphenylethanoyl(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(2,2-diphenylacetyl)-isopentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[3-methylbutyl-(1-oxo-2,2-diphenylethyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2,2-diphenylacetyl)-(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(2,2-diphenylacetyl)-isoamyl-amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C26H30N2O3S MolecularWeight: 450.593

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N2O3S/c1-4-31-26(30)22-18-32-23(27-22)17-28(16-15-19(2)3)25(29)24(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-14,18-19,24H,4,15-17H2,1-3H3