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

Systemtic Name: (E)-N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]-3-(2-propoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[4-cyano-2-(4,8-dimethyl-2-quinolyl)pyrazol-3-yl]-3-(2-propoxyphenyl)prop-2-enamide CAS Name: (E)-N-[4-cyano-2-(4,8-dimethyl-2-quinolinyl)-3-pyrazolyl]-3-(2-propoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[4-cyano-2-(4,8-dimethylquinolin-2-yl)pyrazol-3-yl]-3-(2-propoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[4-cyano-2-(4,8-dimethyl-2-quinolyl)pyrazol-3-yl]-3-(2-propoxyphenyl)acrylamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=CC(=O)NC2=C(C=NN2C3=NC4=C(C=CC=C4C)C(=C3)C)C#N

Isomeric SMILES

CCCOC1=CC=CC=C1/C=C/C(=O)NC2=C(C=NN2C3=NC4=C(C=CC=C4C)C(=C3)C)C#N

InChI

InChI=1S/C27H25N5O2/c1-4-14-34-23-11-6-5-9-20(23)12-13-25(33)31-27-21(16-28)17-29-32(27)24-15-19(3)22-10-7-8-18(2)26(22)30-24/h5-13,15,17H,4,14H2,1-3H3,(H,31,33)/b13-12+