4-[methyl-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoyl]amino]butanoic acid

Systemtic Name: 4-[methyl-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoyl]amino]butanoic acid Openeye Name: 4-[methyl-[2-[(2-methylthiazol-4-yl)methylsulfanyl]acetyl]amino]butanoic acid CAS Name: 4-[methyl-[2-[(2-methyl-4-thiazolyl)methylthio]-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[methyl-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]acetyl]amino]butanoic acid Traditional Name: 4-[methyl-[2-[(2-methylthiazol-4-yl)methylthio]acetyl]amino]butyric acid Formula: C12H18N2O3S2 MolecularWeight: 302.41292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCC(=O)N(C)CCCC(=O)O

Isomeric SMILES

CC1=NC(=CS1)CSCC(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C12H18N2O3S2/c1-9-13-10(7-19-9)6-18-8-11(15)14(2)5-3-4-12(16)17/h7H,3-6,8H2,1-2H3,(H,16,17)