(3,5-dimethylpyrazol-1-yl)-[2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl]methanone

Systemtic Name: (3,5-dimethylpyrazol-1-yl)-[2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl]methanone Openeye Name: (3,5-dimethylpyrazol-1-yl)-[2-(3-isobutoxyphenyl)-4-quinolyl]methanone CAS Name: (3,5-dimethyl-1-pyrazolyl)-[2-[3-(2-methylpropoxy)phenyl]-4-quinolinyl]methanone IUPAC Name: (3,5-dimethylpyrazol-1-yl)-[2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl]methanone Traditional Name: (3,5-dimethylpyrazol-1-yl)-[2-(3-isobutoxyphenyl)-4-quinolyl]methanone Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OCC(C)C)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OCC(C)C)C

InChI

InChI=1S/C25H25N3O2/c1-16(2)15-30-20-9-7-8-19(13-20)24-14-22(21-10-5-6-11-23(21)26-24)25(29)28-18(4)12-17(3)27-28/h5-14,16H,15H2,1-4H3