3-[4-(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)oxyphenyl]-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide

Systemtic Name: 3-[4-(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)oxyphenyl]-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide Openeye Name: 3-[4-(2-chloro-5-fluoro-pyrimidin-4-yl)oxyphenyl]-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide CAS Name: 3-[4-[(2-chloro-5-fluoro-4-pyrimidinyl)oxy]phenyl]-2-cyano-N-(2,4-dimethylphenyl)-2-propenamide IUPAC Name: 3-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxyphenyl]-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide Traditional Name: 3-[4-(2-chloro-5-fluoro-pyrimidin-4-yl)oxyphenyl]-2-cyano-N-(2,4-dimethylphenyl)acrylamide Formula: C22H16ClFN4O2 MolecularWeight: 422.839443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)OC3=NC(=NC=C3F)Cl)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)OC3=NC(=NC=C3F)Cl)C#N)C

InChI

InChI=1S/C22H16ClFN4O2/c1-13-3-8-19(14(2)9-13)27-20(29)16(11-25)10-15-4-6-17(7-5-15)30-21-18(24)12-26-22(23)28-21/h3-10,12H,1-2H3,(H,27,29)