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

Systemtic Name: (phenylmethyl) (2S)-2-[2-(2-azanyl-1,3-thiazol-4-yl)phenoxy]butanoate Openeye Name: benzyl (2S)-2-[2-(2-aminothiazol-4-yl)phenoxy]butanoate CAS Name: (2S)-2-[2-(2-amino-4-thiazolyl)phenoxy]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]butanoate Traditional Name: (2S)-2-[2-(2-aminothiazol-4-yl)phenoxy]butyric acid benzyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC1=CC=CC=C1)OC2=CC=CC=C2C3=CSC(=N3)N

Isomeric SMILES

CC[C@@H](C(=O)OCC1=CC=CC=C1)OC2=CC=CC=C2C3=CSC(=N3)N

InChI

InChI=1S/C20H20N2O3S/c1-2-17(19(23)24-12-14-8-4-3-5-9-14)25-18-11-7-6-10-15(18)16-13-26-20(21)22-16/h3-11,13,17H,2,12H2,1H3,(H2,21,22)/t17-/m0/s1