3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(3-pyridylmethyl)piperazin-1-yl]propan-1-one CAS Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-1-[4-(3-pyridinylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one Traditional Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(3-pyridylmethyl)piperazino]propan-1-one Formula: C20H23BrF3N5O MolecularWeight: 486.32873

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NN2CCC(=O)N3CCN(CC3)CC4=CN=CC=C4)C(F)(F)F)Br

Isomeric SMILES

C1CC1C2=C(C(=NN2CCC(=O)N3CCN(CC3)CC4=CN=CC=C4)C(F)(F)F)Br

InChI

InChI=1S/C20H23BrF3N5O/c21-17-18(15-3-4-15)29(26-19(17)20(22,23)24)7-5-16(30)28-10-8-27(9-11-28)13-14-2-1-6-25-12-14/h1-2,6,12,15H,3-5,7-11,13H2