[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl (2S)-2-phenoxypropanoate

Systemtic Name: [2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl (2S)-2-phenoxypropanoate Openeye Name: [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl (2S)-2-phenoxypropanoate CAS Name: (2S)-2-phenoxypropanoic acid [2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl (2S)-2-phenoxypropanoate Traditional Name: (2S)-2-phenoxypropionic acid [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl ester Formula: C20H18BrNO4S MolecularWeight: 448.33022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CSC(=N1)C2=C(C=CC(=C2)Br)OC)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OCC1=CSC(=N1)C2=C(C=CC(=C2)Br)OC)OC3=CC=CC=C3

InChI

InChI=1S/C20H18BrNO4S/c1-13(26-16-6-4-3-5-7-16)20(23)25-11-15-12-27-19(22-15)17-10-14(21)8-9-18(17)24-2/h3-10,12-13H,11H2,1-2H3/t13-/m0/s1