4-methyl-2-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoylamino]pentanoic acid Openeye Name: 4-methyl-2-[[2-[(2-methylthiazol-4-yl)methylsulfanyl]acetyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[2-[(2-methyl-4-thiazolyl)methylthio]-1-oxoethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]acetyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[2-[(2-methylthiazol-4-yl)methylthio]acetyl]amino]valeric acid Formula: C13H20N2O3S2 MolecularWeight: 316.4395

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O3S2/c1-8(2)4-11(13(17)18)15-12(16)7-19-5-10-6-20-9(3)14-10/h6,8,11H,4-5,7H2,1-3H3,(H,15,16)(H,17,18)