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

Systemtic Name: (E)-N-butyl-3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-cyano-prop-2-enamide Openeye Name: (E)-N-butyl-3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-cyano-prop-2-enamide CAS Name: (E)-N-butyl-3-[5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-2-cyano-2-propenamide IUPAC Name: (E)-N-butyl-3-[5-chloro-1-(4-fluorophenyl)-3-methylpyrazol-4-yl]-2-cyanoprop-2-enamide Traditional Name: (E)-N-butyl-3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-2-cyano-acrylamide Formula: C18H18ClFN4O MolecularWeight: 360.813123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=C(N(N=C1C)C2=CC=C(C=C2)F)Cl)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=C(N(N=C1C)C2=CC=C(C=C2)F)Cl)/C#N

InChI

InChI=1S/C18H18ClFN4O/c1-3-4-9-22-18(25)13(11-21)10-16-12(2)23-24(17(16)19)15-7-5-14(20)6-8-15/h5-8,10H,3-4,9H2,1-2H3,(H,22,25)/b13-10+