(2R)-2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: (2R)-2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2R)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2R)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2R)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2R)-2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-1-(4-phenylpiperazino)propan-1-one Formula: C18H20BrF3N4O MolecularWeight: 445.27681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)N2CCN(CC2)C3=CC=CC=C3)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1[C@H](C)C(=O)N2CCN(CC2)C3=CC=CC=C3)C(F)(F)F)Br

InChI

InChI=1S/C18H20BrF3N4O/c1-12-15(19)16(18(20,21)22)23-26(12)13(2)17(27)25-10-8-24(9-11-25)14-6-4-3-5-7-14/h3-7,13H,8-11H2,1-2H3/t13-/m1/s1