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

Systemtic Name: 3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(3-pyridylmethyl)piperazin-1-yl]propan-1-one CAS Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-1-[4-(3-pyridinylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one Traditional Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(3-pyridylmethyl)piperazino]propan-1-one Formula: C18H21BrF3N5O MolecularWeight: 460.29145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)CC3=CN=CC=C3)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)CC3=CN=CC=C3)C(F)(F)F)Br

InChI

InChI=1S/C18H21BrF3N5O/c1-13-16(19)17(18(20,21)22)24-27(13)6-4-15(28)26-9-7-25(8-10-26)12-14-3-2-5-23-11-14/h2-3,5,11H,4,6-10,12H2,1H3