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

Systemtic Name: [2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl 3-fluoranylbenzoate Openeye Name: [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl ester Formula: C18H13BrFNO3S MolecularWeight: 422.268123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)COC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)COC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H13BrFNO3S/c1-23-16-6-5-12(19)8-15(16)17-21-14(10-25-17)9-24-18(22)11-3-2-4-13(20)7-11/h2-8,10H,9H2,1H3