methyl (2S)-2-azanyl-3-[4-(4,5-dihydro-1,3-thiazol-2-yl)phenyl]propanoate

Systemtic Name: methyl (2S)-2-azanyl-3-[4-(4,5-dihydro-1,3-thiazol-2-yl)phenyl]propanoate Openeye Name: methyl (2S)-2-amino-3-[4-(4,5-dihydrothiazol-2-yl)phenyl]propanoate CAS Name: (2S)-2-amino-3-[4-(4,5-dihydrothiazol-2-yl)phenyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-3-[4-(4,5-dihydro-1,3-thiazol-2-yl)phenyl]propanoate Traditional Name: (2S)-2-amino-3-[4-(2-thiazolin-2-yl)phenyl]propionic acid methyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)C2=NCCS2)N

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)C2=NCCS2)N

InChI

InChI=1S/C13H16N2O2S/c1-17-13(16)11(14)8-9-2-4-10(5-3-9)12-15-6-7-18-12/h2-5,11H,6-8,14H2,1H3/t11-/m0/s1