2-azanyl-3-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[[5-(3-chlorophenyl)oxazol-2-yl]methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[[5-(3-chlorophenyl)-2-oxazolyl]methylthio]propanoic acid IUPAC Name: 2-amino-3-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[[5-(3-chlorophenyl)oxazol-2-yl]methylthio]propionic acid Formula: C13H13ClN2O3S MolecularWeight: 312.77192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=CN=C(O2)CSCC(C(=O)O)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=CN=C(O2)CSCC(C(=O)O)N

InChI

InChI=1S/C13H13ClN2O3S/c14-9-3-1-2-8(4-9)11-5-16-12(19-11)7-20-6-10(15)13(17)18/h1-5,10H,6-7,15H2,(H,17,18)