N-(3-bromophenyl)-6-[4-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N-(3-bromophenyl)-6-[4-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]pyrimidin-4-amine Openeye Name: N-(3-bromophenyl)-6-[4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-6-[4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-(3-bromophenyl)-6-[4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]piperazin-1-yl]pyrimidin-4-amine Traditional Name: (3-bromophenyl)-[6-[4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]piperazino]pyrimidin-4-yl]amine Formula: C23H23BrFN5O2 MolecularWeight: 500.363423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C3C(=CC(=C2)F)COCO3)C4=CC(=NC=N4)NC5=CC(=CC=C5)Br

Isomeric SMILES

C1CN(CCN1CC2=C3C(=CC(=C2)F)COCO3)C4=CC(=NC=N4)NC5=CC(=CC=C5)Br

InChI

InChI=1S/C23H23BrFN5O2/c24-18-2-1-3-20(10-18)28-21-11-22(27-14-26-21)30-6-4-29(5-7-30)12-16-8-19(25)9-17-13-31-15-32-23(16)17/h1-3,8-11,14H,4-7,12-13,15H2,(H,26,27,28)