(Z)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cycloheptyl-prop-2-enamide

Systemtic Name: (Z)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cycloheptyl-prop-2-enamide Openeye Name: (Z)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cycloheptyl-prop-2-enamide CAS Name: (Z)-3-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-2-cyano-N-cycloheptyl-2-propenamide IUPAC Name: (Z)-3-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-cycloheptylprop-2-enamide Traditional Name: (Z)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-cycloheptyl-acrylamide Formula: C26H25ClN4O MolecularWeight: 444.9559

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCCC(CC1)NC(=O)/C(=C\C2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C26H25ClN4O/c27-22-14-12-19(13-15-22)25-21(18-31(30-25)24-10-6-3-7-11-24)16-20(17-28)26(32)29-23-8-4-1-2-5-9-23/h3,6-7,10-16,18,23H,1-2,4-5,8-9H2,(H,29,32)/b20-16-