3-(4-bromanylpyrazol-1-yl)-1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 3-(4-bromopyrazol-1-yl)-1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 3-(4-bromo-1-pyrazolyl)-1-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 3-(4-bromopyrazol-1-yl)-1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 3-(4-bromopyrazol-1-yl)-1-[4-(2-fluorobenzyl)piperazino]-2-methyl-propan-1-one Formula: C18H22BrFN4O MolecularWeight: 409.295883

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)Br)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

Isomeric SMILES

CC(CN1C=C(C=N1)Br)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C18H22BrFN4O/c1-14(11-24-13-16(19)10-21-24)18(25)23-8-6-22(7-9-23)12-15-4-2-3-5-17(15)20/h2-5,10,13-14H,6-9,11-12H2,1H3