3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-cyano-N-(2-ethoxyphenyl)prop-2-enamide

Systemtic Name: 3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-cyano-N-(2-ethoxyphenyl)prop-2-enamide Openeye Name: 3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-cyano-N-(2-ethoxyphenyl)prop-2-enamide CAS Name: 3-[5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-2-cyano-N-(2-ethoxyphenyl)-2-propenamide IUPAC Name: 3-[5-chloro-1-(4-fluorophenyl)-3-methylpyrazol-4-yl]-2-cyano-N-(2-ethoxyphenyl)prop-2-enamide Traditional Name: 3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-cyano-N-o-phenetyl-acrylamide Formula: C22H18ClFN4O2 MolecularWeight: 424.855323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(=CC2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl)C#N

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(=CC2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl)C#N

InChI

InChI=1S/C22H18ClFN4O2/c1-3-30-20-7-5-4-6-19(20)26-22(29)15(13-25)12-18-14(2)27-28(21(18)23)17-10-8-16(24)9-11-17/h4-12H,3H2,1-2H3,(H,26,29)