[6-bromanyl-2-(4-butylphenyl)quinolin-4-yl]-(3,5-dimethylpyrazol-1-yl)methanone

Systemtic Name: [6-bromanyl-2-(4-butylphenyl)quinolin-4-yl]-(3,5-dimethylpyrazol-1-yl)methanone Openeye Name: [6-bromo-2-(4-butylphenyl)-4-quinolyl]-(3,5-dimethylpyrazol-1-yl)methanone CAS Name: [6-bromo-2-(4-butylphenyl)-4-quinolinyl]-(3,5-dimethyl-1-pyrazolyl)methanone IUPAC Name: [6-bromo-2-(4-butylphenyl)quinolin-4-yl]-(3,5-dimethylpyrazol-1-yl)methanone Traditional Name: [6-bromo-2-(4-butylphenyl)-4-quinolyl]-(3,5-dimethylpyrazol-1-yl)methanone Formula: C25H24BrN3O MolecularWeight: 462.38156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4C(=CC(=N4)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4C(=CC(=N4)C)C

InChI

InChI=1S/C25H24BrN3O/c1-4-5-6-18-7-9-19(10-8-18)24-15-22(21-14-20(26)11-12-23(21)27-24)25(30)29-17(3)13-16(2)28-29/h7-15H,4-6H2,1-3H3