2-[2-(3,5,5-trimethylhexanoylamino)-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-(3,5,5-trimethylhexanoylamino)-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-(3,5,5-trimethylhexanoylamino)thiazol-4-yl]acetic acid CAS Name: 2-[2-[(3,5,5-trimethyl-1-oxohexyl)amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-(3,5,5-trimethylhexanoylamino)-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-(3,5,5-trimethylhexanoylamino)thiazol-4-yl]acetic acid Formula: C14H22N2O3S MolecularWeight: 298.40108

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=NC(=CS1)CC(=O)O)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)NC1=NC(=CS1)CC(=O)O)CC(C)(C)C

InChI

InChI=1S/C14H22N2O3S/c1-9(7-14(2,3)4)5-11(17)16-13-15-10(8-20-13)6-12(18)19/h8-9H,5-7H2,1-4H3,(H,18,19)(H,15,16,17)