(E)-N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]-3-(4-phenylmethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]-3-(4-phenylmethoxyphenyl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxyphenyl)-N-[4-cyano-2-(4,8-dimethyl-2-quinolyl)pyrazol-3-yl]prop-2-enamide CAS Name: (E)-N-[4-cyano-2-(4,8-dimethyl-2-quinolinyl)-3-pyrazolyl]-3-(4-phenylmethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]-3-(4-phenylmethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxyphenyl)-N-[4-cyano-2-(4,8-dimethyl-2-quinolyl)pyrazol-3-yl]acrylamide Formula: C31H25N5O2 MolecularWeight: 499.5625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)N3C(=C(C=N3)C#N)NC(=O)C=CC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)N3C(=C(C=N3)C#N)NC(=O)/C=C/C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C31H25N5O2/c1-21-7-6-10-27-22(2)17-28(34-30(21)27)36-31(25(18-32)19-33-36)35-29(37)16-13-23-11-14-26(15-12-23)38-20-24-8-4-3-5-9-24/h3-17,19H,20H2,1-2H3,(H,35,37)/b16-13+