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

Systemtic Name: ethyl 4-methyl-2-(3-methylbutanoylamino)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-(3-methylbutanoylamino)thiazole-5-carboxylate CAS Name: 4-methyl-2-[(3-methyl-1-oxobutyl)amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-(3-methylbutanoylamino)-1,3-thiazole-5-carboxylate Traditional Name: 2-(isovalerylamino)-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CC(C)C)C

InChI

InChI=1S/C12H18N2O3S/c1-5-17-11(16)10-8(4)13-12(18-10)14-9(15)6-7(2)3/h7H,5-6H2,1-4H3,(H,13,14,15)