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

Systemtic Name: [2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl 2-benzamidopropanoate Openeye Name: [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl 2-benzamidopropanoate CAS Name: 2-benzamidopropanoic acid [2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 2-benzamidopropanoate Traditional Name: 2-benzamidopropionic acid [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl ester Formula: C21H19BrN2O4S MolecularWeight: 475.35556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrN2O4S/c1-13(23-19(25)14-6-4-3-5-7-14)21(26)28-11-16-12-29-20(24-16)17-10-15(22)8-9-18(17)27-2/h3-10,12-13H,11H2,1-2H3,(H,23,25)