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

Systemtic Name: 3-(3-bromanyl-4-fluoranyl-phenyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]prop-2-enamide Openeye Name: 3-(3-bromo-4-fluoro-phenyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]prop-2-enamide CAS Name: 3-(3-bromo-4-fluorophenyl)-N-[1-(4-cyanobutyl)-4-pyrazolyl]-2-propenamide IUPAC Name: 3-(3-bromo-4-fluorophenyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]prop-2-enamide Traditional Name: 3-(3-bromo-4-fluoro-phenyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]acrylamide Formula: C17H16BrFN4O MolecularWeight: 391.237543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)NC2=CN(N=C2)CCCCC#N)Br)F

Isomeric SMILES

C1=CC(=C(C=C1C=CC(=O)NC2=CN(N=C2)CCCCC#N)Br)F

InChI

InChI=1S/C17H16BrFN4O/c18-15-10-13(4-6-16(15)19)5-7-17(24)22-14-11-21-23(12-14)9-3-1-2-8-20/h4-7,10-12H,1-3,9H2,(H,22,24)