2-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)ethanoic acid

Systemtic Name: 2-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)ethanoic acid Openeye Name: 2-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)acetic acid CAS Name: 2-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-2-(2-phenyl-1H-indol-3-yl)acetic acid IUPAC Name: 2-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-(2-phenyl-1H-indol-3-yl)acetic acid Traditional Name: 2-[4-(5-bromopyrimidin-2-yl)piperazino]-2-(2-phenyl-1H-indol-3-yl)acetic acid Formula: C24H22BrN5O2 MolecularWeight: 492.36778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)Br)C(C3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)Br)C(C3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C24H22BrN5O2/c25-17-14-26-24(27-15-17)30-12-10-29(11-13-30)22(23(31)32)20-18-8-4-5-9-19(18)28-21(20)16-6-2-1-3-7-16/h1-9,14-15,22,28H,10-13H2,(H,31,32)