N-(3-bromophenyl)-6-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N-(3-bromophenyl)-6-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-amine Openeye Name: N-(3-bromophenyl)-6-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-6-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-(3-bromophenyl)-6-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-amine Traditional Name: (3-bromophenyl)-[6-[4-(2-fluorobenzyl)piperazino]pyrimidin-4-yl]amine Formula: C21H21BrFN5 MolecularWeight: 442.327343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2F)C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2F)C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H21BrFN5/c22-17-5-3-6-18(12-17)26-20-13-21(25-15-24-20)28-10-8-27(9-11-28)14-16-4-1-2-7-19(16)23/h1-7,12-13,15H,8-11,14H2,(H,24,25,26)