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

Systemtic Name: ethyl 2-[[3-methylbutyl(octanoyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[isopentyl(octanoyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[3-methylbutyl(1-oxooctyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-methylbutyl(octanoyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[caprylyl(isoamyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C20H34N2O3S MolecularWeight: 382.56056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(CCC(C)C)CC1=NC(=CS1)C(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)N(CCC(C)C)CC1=NC(=CS1)C(=O)OCC

InChI

InChI=1S/C20H34N2O3S/c1-5-7-8-9-10-11-19(23)22(13-12-16(3)4)14-18-21-17(15-26-18)20(24)25-6-2/h15-16H,5-14H2,1-4H3