2-azanyl-3-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[[2-(p-tolyl)thiazol-4-yl]methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[[2-(4-methylphenyl)-4-thiazolyl]methylthio]propanoic acid IUPAC Name: 2-amino-3-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[[2-(p-tolyl)thiazol-4-yl]methylthio]propionic acid Formula: C14H16N2O2S2 MolecularWeight: 308.41904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)CSCC(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)CSCC(C(=O)O)N

InChI

InChI=1S/C14H16N2O2S2/c1-9-2-4-10(5-3-9)13-16-11(7-20-13)6-19-8-12(15)14(17)18/h2-5,7,12H,6,8,15H2,1H3,(H,17,18)