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

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

CCC(C)C(C(=O)O)NC(=O)CSCC1=CSC(=N1)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CSCC1=CSC(=N1)C

InChI

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