3-[4-(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)oxy-3-methoxy-phenyl]-2-cyano-N-(2-methoxyphenyl)prop-2-enamide

Systemtic Name: 3-[4-(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)oxy-3-methoxy-phenyl]-2-cyano-N-(2-methoxyphenyl)prop-2-enamide Openeye Name: 3-[4-(2-chloro-5-fluoro-pyrimidin-4-yl)oxy-3-methoxy-phenyl]-2-cyano-N-(2-methoxyphenyl)prop-2-enamide CAS Name: 3-[4-[(2-chloro-5-fluoro-4-pyrimidinyl)oxy]-3-methoxyphenyl]-2-cyano-N-(2-methoxyphenyl)-2-propenamide IUPAC Name: 3-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxy-3-methoxyphenyl]-2-cyano-N-(2-methoxyphenyl)prop-2-enamide Traditional Name: 3-[4-(2-chloro-5-fluoro-pyrimidin-4-yl)oxy-3-methoxy-phenyl]-2-cyano-N-(2-methoxyphenyl)acrylamide Formula: C22H16ClFN4O4 MolecularWeight: 454.838243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C(=CC2=CC(=C(C=C2)OC3=NC(=NC=C3F)Cl)OC)C#N

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C(=CC2=CC(=C(C=C2)OC3=NC(=NC=C3F)Cl)OC)C#N

InChI

InChI=1S/C22H16ClFN4O4/c1-30-17-6-4-3-5-16(17)27-20(29)14(11-25)9-13-7-8-18(19(10-13)31-2)32-21-15(24)12-26-22(23)28-21/h3-10,12H,1-2H3,(H,27,29)