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

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]prop-2-enamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]prop-2-enamide CAS Name: 3-(2-chloro-6-fluorophenyl)-N-[1-(4-cyanobutyl)-4-pyrazolyl]-2-propenamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]prop-2-enamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]acrylamide Formula: C17H16ClFN4O MolecularWeight: 346.786543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClFN4O/c18-15-5-4-6-16(19)14(15)7-8-17(24)22-13-11-21-23(12-13)10-3-1-2-9-20/h4-8,11-12H,1-3,10H2,(H,22,24)