methyl 4-methyl-2-(3-methylbutanoylamino)-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-methyl-2-(3-methylbutanoylamino)-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-methyl-2-(3-methylbutanoylamino)thiazole-5-carboxylate CAS Name: 4-methyl-2-[(3-methyl-1-oxobutyl)amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-(3-methylbutanoylamino)-1,3-thiazole-5-carboxylate Traditional Name: 2-(isovalerylamino)-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C11H16N2O3S MolecularWeight: 256.32134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CC(C)C)C(=O)OC

InChI

InChI=1S/C11H16N2O3S/c1-6(2)5-8(14)13-11-12-7(3)9(17-11)10(15)16-4/h6H,5H2,1-4H3,(H,12,13,14)