N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-(2-methylphenoxy)butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCC(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C(=C3)C)C#N

Isomeric SMILES

CC1=CC=CC=C1OCCCC(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C(=C3)C)C#N

InChI

InChI=1S/C25H23N5O2/c1-17-8-3-6-11-22(17)32-13-7-12-24(31)29-25-19(15-26)16-27-30(25)23-14-18(2)20-9-4-5-10-21(20)28-23/h3-6,8-11,14,16H,7,12-13H2,1-2H3,(H,29,31)