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

Systemtic Name: (E)-3-(4-tert-butylphenyl)-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)prop-2-enamide Openeye Name: (E)-3-(4-tert-butylphenyl)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]prop-2-enamide CAS Name: (E)-3-(4-tert-butylphenyl)-N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(4-tert-butylphenyl)-N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)prop-2-enamide Traditional Name: (E)-3-(4-tert-butylphenyl)-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]acrylamide Formula: C26H23N5O MolecularWeight: 421.49372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23N5O/c1-26(2,3)21-12-8-18(9-13-21)10-15-24(32)30-25-20(16-27)17-28-31(25)23-14-11-19-6-4-5-7-22(19)29-23/h4-15,17H,1-3H3,(H,30,32)/b15-10+