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

Systemtic Name: methyl 2-[[4-chloranylbutanoyl(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[4-chlorobutanoyl(isopentyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[(4-chloro-1-oxobutyl)-(3-methylbutyl)amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-chlorobutanoyl(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[4-chlorobutanoyl(isoamyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C15H23ClN2O3S MolecularWeight: 346.87272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC1=NC(=CS1)C(=O)OC)C(=O)CCCCl

Isomeric SMILES

CC(C)CCN(CC1=NC(=CS1)C(=O)OC)C(=O)CCCCl

InChI

InChI=1S/C15H23ClN2O3S/c1-11(2)6-8-18(14(19)5-4-7-16)9-13-17-12(10-22-13)15(20)21-3/h10-11H,4-9H2,1-3H3