methyl (2S)-2-[4-(2-azanyl-1,3-thiazol-4-yl)phenoxy]propanoate

Systemtic Name: methyl (2S)-2-[4-(2-azanyl-1,3-thiazol-4-yl)phenoxy]propanoate Openeye Name: methyl (2S)-2-[4-(2-aminothiazol-4-yl)phenoxy]propanoate CAS Name: (2S)-2-[4-(2-amino-4-thiazolyl)phenoxy]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]propanoate Traditional Name: (2S)-2-[4-(2-aminothiazol-4-yl)phenoxy]propionic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=CC=C(C=C1)C2=CSC(=N2)N

Isomeric SMILES

C[C@@H](C(=O)OC)OC1=CC=C(C=C1)C2=CSC(=N2)N

InChI

InChI=1S/C13H14N2O3S/c1-8(12(16)17-2)18-10-5-3-9(4-6-10)11-7-19-13(14)15-11/h3-8H,1-2H3,(H2,14,15)/t8-/m0/s1