4-[[methyl(2-methylbutyl)amino]methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[[methyl(2-methylbutyl)amino]methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[[methyl(2-methylbutyl)amino]methyl]thiazole-2-carboxylic acid CAS Name: 4-[[methyl(2-methylbutyl)amino]methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[[methyl(2-methylbutyl)amino]methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[[methyl(2-methylbutyl)amino]methyl]thiazole-2-carboxylic acid Formula: C11H18N2O2S MolecularWeight: 242.33782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN(C)CC1=CSC(=N1)C(=O)O

Isomeric SMILES

CCC(C)CN(C)CC1=CSC(=N1)C(=O)O

InChI

InChI=1S/C11H18N2O2S/c1-4-8(2)5-13(3)6-9-7-16-10(12-9)11(14)15/h7-8H,4-6H2,1-3H3,(H,14,15)