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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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