(E)-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-3-(4-phenylmethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-3-(4-phenylmethoxyphenyl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxyphenyl)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]prop-2-enamide CAS Name: (E)-N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-3-(4-phenylmethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-3-(4-phenylmethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxyphenyl)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]acrylamide Formula: C29H21N5O2 MolecularWeight: 471.50934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C=CC(=O)NC3=C(C=NN3C4=NC5=CC=CC=C5C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=C/C(=O)NC3=C(C=NN3C4=NC5=CC=CC=C5C=C4)C#N

InChI

InChI=1S/C29H21N5O2/c30-18-24-19-31-34(27-16-13-23-8-4-5-9-26(23)32-27)29(24)33-28(35)17-12-21-10-14-25(15-11-21)36-20-22-6-2-1-3-7-22/h1-17,19H,20H2,(H,33,35)/b17-12+