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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O3S2/c1-9(2)5-12(14(18)19-4)16-13(17)8-20-6-11-7-21-10(3)15-11/h7,9,12H,5-6,8H2,1-4H3,(H,16,17)