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

Systemtic Name: cyclohexyl (2S)-2-[3-(2-azanyl-1,3-thiazol-4-yl)phenoxy]propanoate Openeye Name: cyclohexyl (2S)-2-[3-(2-aminothiazol-4-yl)phenoxy]propanoate CAS Name: (2S)-2-[3-(2-amino-4-thiazolyl)phenoxy]propanoic acid cyclohexyl ester IUPAC Name: cyclohexyl (2S)-2-[3-(2-amino-1,3-thiazol-4-yl)phenoxy]propanoate Traditional Name: (2S)-2-[3-(2-aminothiazol-4-yl)phenoxy]propionic acid cyclohexyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CCCCC1)OC2=CC=CC(=C2)C3=CSC(=N3)N

Isomeric SMILES

C[C@@H](C(=O)OC1CCCCC1)OC2=CC=CC(=C2)C3=CSC(=N3)N

InChI

InChI=1S/C18H22N2O3S/c1-12(17(21)23-14-7-3-2-4-8-14)22-15-9-5-6-13(10-15)16-11-24-18(19)20-16/h5-6,9-12,14H,2-4,7-8H2,1H3,(H2,19,20)/t12-/m0/s1