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

Systemtic Name: 4-methyl-2-[3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propanoylamino]pentanoic acid Openeye Name: 4-methyl-2-[3-[(2-methylthiazol-4-yl)methylsulfanyl]propanoylamino]pentanoic acid CAS Name: 4-methyl-2-[[3-[(2-methyl-4-thiazolyl)methylthio]-1-oxopropyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propanoylamino]pentanoic acid Traditional Name: 4-methyl-2-[3-[(2-methylthiazol-4-yl)methylthio]propanoylamino]valeric acid Formula: C14H22N2O3S2 MolecularWeight: 330.46608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O3S2/c1-9(2)6-12(14(18)19)16-13(17)4-5-20-7-11-8-21-10(3)15-11/h8-9,12H,4-7H2,1-3H3,(H,16,17)(H,18,19)