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

Systemtic Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-4-isobutoxy-benzamide CAS Name: N-[4-cyano-2-(4-methyl-2-quinolinyl)-3-pyrazolyl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-(2-methylpropoxy)benzamide Traditional Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-4-isobutoxy-benzamide Formula: C25H23N5O2 MolecularWeight: 425.48242

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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)OCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H23N5O2/c1-16(2)15-32-20-10-8-18(9-11-20)25(31)29-24-19(13-26)14-27-30(24)23-12-17(3)21-6-4-5-7-22(21)28-23/h4-12,14,16H,15H2,1-3H3,(H,29,31)