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

Systemtic Name: (Z)-3-[3-(4-butoxy-3-chloranyl-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-prop-2-enyl-prop-2-enamide Openeye Name: (Z)-N-allyl-3-[3-(4-butoxy-3-chloro-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-prop-2-enamide CAS Name: (Z)-3-[3-(4-butoxy-3-chlorophenyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-prop-2-enyl-2-propenamide IUPAC Name: (Z)-3-[3-(4-butoxy-3-chlorophenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-prop-2-enylprop-2-enamide Traditional Name: (Z)-N-allyl-3-[3-(4-butoxy-3-chloro-phenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-acrylamide Formula: C26H25ClN4O2 MolecularWeight: 460.9553

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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=C)C3=CC=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H25ClN4O2/c1-3-5-14-33-24-12-11-19(16-23(24)27)25-21(15-20(17-28)26(32)29-13-4-2)18-31(30-25)22-9-7-6-8-10-22/h4,6-12,15-16,18H,2-3,5,13-14H2,1H3,(H,29,32)/b20-15-