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

Systemtic Name: 2-cyclopropyl-2-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoylamino]propanoic acid Openeye Name: 2-cyclopropyl-2-[[2-[(2-methylthiazol-4-yl)methylsulfanyl]acetyl]amino]propanoic acid CAS Name: 2-cyclopropyl-2-[[2-[(2-methyl-4-thiazolyl)methylthio]-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-cyclopropyl-2-[[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]acetyl]amino]propanoic acid Traditional Name: 2-cyclopropyl-2-[[2-[(2-methylthiazol-4-yl)methylthio]acetyl]amino]propionic acid Formula: C13H18N2O3S2 MolecularWeight: 314.42362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCC(=O)NC(C)(C2CC2)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)CSCC(=O)NC(C)(C2CC2)C(=O)O

InChI

InChI=1S/C13H18N2O3S2/c1-8-14-10(6-20-8)5-19-7-11(16)15-13(2,12(17)18)9-3-4-9/h6,9H,3-5,7H2,1-2H3,(H,15,16)(H,17,18)