4-tert-butyl-N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]benzamide Openeye Name: 4-tert-butyl-N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]benzamide CAS Name: 4-tert-butyl-N-[4-cyano-2-(4-methyl-2-quinolinyl)-3-pyrazolyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]benzamide Traditional Name: 4-tert-butyl-N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]benzamide Formula: C25H23N5O MolecularWeight: 409.48302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C25H23N5O/c1-16-13-22(28-21-8-6-5-7-20(16)21)30-23(18(14-26)15-27-30)29-24(31)17-9-11-19(12-10-17)25(2,3)4/h5-13,15H,1-4H3,(H,29,31)