(E)-2-cyano-3-[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(4-methylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(p-tolyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(4-hexoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(4-hexoxyphenyl)-1-phenylpyrazol-4-yl]-N-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(p-tolyl)acrylamide Formula: C32H32N4O2 MolecularWeight: 504.62208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3=CC=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C32H32N4O2/c1-3-4-5-9-20-38-30-18-14-25(15-19-30)31-27(23-36(35-31)29-10-7-6-8-11-29)21-26(22-33)32(37)34-28-16-12-24(2)13-17-28/h6-8,10-19,21,23H,3-5,9,20H2,1-2H3,(H,34,37)/b26-21+