(Z)-3-[3-(4-butoxy-3-chloranyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-ethyl-prop-2-enamide

Systemtic Name: (Z)-3-[3-(4-butoxy-3-chloranyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-ethyl-prop-2-enamide Openeye Name: (Z)-3-[3-(4-butoxy-3-chloro-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-ethyl-prop-2-enamide CAS Name: (Z)-3-[3-(4-butoxy-3-chlorophenyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-ethyl-2-propenamide IUPAC Name: (Z)-3-[3-(4-butoxy-3-chlorophenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-ethylprop-2-enamide Traditional Name: (Z)-3-[3-(4-butoxy-3-chloro-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-ethyl-acrylamide Formula: C25H25ClN4O2 MolecularWeight: 448.9446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C(/C#N)\C(=O)NCC)C3=CC=CC=C3)Cl

InChI

InChI=1S/C25H25ClN4O2/c1-3-5-13-32-23-12-11-18(15-22(23)26)24-20(14-19(16-27)25(31)28-4-2)17-30(29-24)21-9-7-6-8-10-21/h6-12,14-15,17H,3-5,13H2,1-2H3,(H,28,31)/b19-14-