6-methyl-5-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-5-oxidanyl-3-oxidanylidene-heptanoic acid

Systemtic Name: 6-methyl-5-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-5-oxidanyl-3-oxidanylidene-heptanoic acid Openeye Name: 5-hydroxy-6-methyl-5-[2-(2-methylthiazol-4-yl)ethyl]-3-oxo-heptanoic acid CAS Name: 5-hydroxy-6-methyl-5-[2-(2-methyl-4-thiazolyl)ethyl]-3-oxoheptanoic acid IUPAC Name: 5-hydroxy-6-methyl-5-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-oxoheptanoic acid Traditional Name: 5-hydroxy-3-keto-6-methyl-5-[2-(2-methylthiazol-4-yl)ethyl]enanthic acid Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CCC(CC(=O)CC(=O)O)(C(C)C)O

Isomeric SMILES

CC1=NC(=CS1)CCC(CC(=O)CC(=O)O)(C(C)C)O

InChI

InChI=1S/C14H21NO4S/c1-9(2)14(19,7-12(16)6-13(17)18)5-4-11-8-20-10(3)15-11/h8-9,19H,4-7H2,1-3H3,(H,17,18)