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

Systemtic Name: methyl (2S)-2-[3-(2-azanyl-1,3-thiazol-4-yl)phenoxy]butanoate Openeye Name: methyl (2S)-2-[3-(2-aminothiazol-4-yl)phenoxy]butanoate CAS Name: (2S)-2-[3-(2-amino-4-thiazolyl)phenoxy]butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(2-amino-1,3-thiazol-4-yl)phenoxy]butanoate Traditional Name: (2S)-2-[3-(2-aminothiazol-4-yl)phenoxy]butyric acid methyl ester Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3S/c1-3-12(13(17)18-2)19-10-6-4-5-9(7-10)11-8-20-14(15)16-11/h4-8,12H,3H2,1-2H3,(H2,15,16)/t12-/m0/s1