3-(3-bromanyl-4-fluoranyl-phenyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]prop-2-enamide

Systemtic Name: 3-(3-bromanyl-4-fluoranyl-phenyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]prop-2-enamide Openeye Name: 3-(3-bromo-4-fluoro-phenyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]prop-2-enamide CAS Name: 3-(3-bromo-4-fluorophenyl)-N-[1-[(3-cyanophenyl)methyl]-4-pyrazolyl]-2-propenamide IUPAC Name: 3-(3-bromo-4-fluorophenyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]prop-2-enamide Traditional Name: 3-(3-bromo-4-fluoro-phenyl)-N-[1-(3-cyanobenzyl)pyrazol-4-yl]acrylamide Formula: C20H14BrFN4O MolecularWeight: 425.253763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=C(C=N2)NC(=O)C=CC3=CC(=C(C=C3)F)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=C(C=N2)NC(=O)C=CC3=CC(=C(C=C3)F)Br)C#N

InChI

InChI=1S/C20H14BrFN4O/c21-18-9-14(4-6-19(18)22)5-7-20(27)25-17-11-24-26(13-17)12-16-3-1-2-15(8-16)10-23/h1-9,11,13H,12H2,(H,25,27)