methyl 5-[[4-[3-(3-bromanyl-4-fluoranyl-phenyl)prop-2-enoylamino]pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[3-(3-bromanyl-4-fluoranyl-phenyl)prop-2-enoylamino]pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[3-(3-bromo-4-fluoro-phenyl)prop-2-enoylamino]pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-[[3-(3-bromo-4-fluorophenyl)-1-oxoprop-2-enyl]amino]-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[3-(3-bromo-4-fluorophenyl)prop-2-enoylamino]pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[[3-(3-bromo-4-fluoro-phenyl)acryloyl]amino]pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C19H15BrFN3O4 MolecularWeight: 448.242503

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CN2C=C(C=N2)NC(=O)C=CC3=CC(=C(C=C3)F)Br

Isomeric SMILES

COC(=O)C1=CC=C(O1)CN2C=C(C=N2)NC(=O)C=CC3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C19H15BrFN3O4/c1-27-19(26)17-6-4-14(28-17)11-24-10-13(9-22-24)23-18(25)7-3-12-2-5-16(21)15(20)8-12/h2-10H,11H2,1H3,(H,23,25)