3-(2-chloranyl-6-fluoranyl-phenyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]prop-2-enamide

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]prop-2-enamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]prop-2-enamide CAS Name: 3-(2-chloro-6-fluorophenyl)-N-[1-[(3-cyanophenyl)methyl]-4-pyrazolyl]-2-propenamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-N-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]prop-2-enamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-N-[1-(3-cyanobenzyl)pyrazol-4-yl]acrylamide Formula: C20H14ClFN4O MolecularWeight: 380.802763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=C(C=N2)NC(=O)C=CC3=C(C=CC=C3Cl)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=C(C=N2)NC(=O)C=CC3=C(C=CC=C3Cl)F)C#N

InChI

InChI=1S/C20H14ClFN4O/c21-18-5-2-6-19(22)17(18)7-8-20(27)25-16-11-24-26(13-16)12-15-4-1-3-14(9-15)10-23/h1-9,11,13H,12H2,(H,25,27)