3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)pyrazol-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)pyrazol-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)pyrazol-3-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)-3-pyrazolyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)pyrazol-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)pyrazol-3-yl]methanone Formula: C27H24FN3O3 MolecularWeight: 457.496163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN(C(=C2)C(=O)N3CCC4=CC=CC=C4C3)C5=CC=C(C=C5)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN(C(=C2)C(=O)N3CCC4=CC=CC=C4C3)C5=CC=C(C=C5)F)OC

InChI

InChI=1S/C27H24FN3O3/c1-33-22-11-12-23(26(15-22)34-2)24-16-25(31(29-24)21-9-7-20(28)8-10-21)27(32)30-14-13-18-5-3-4-6-19(18)17-30/h3-12,15-16H,13-14,17H2,1-2H3