4-[3-[(2-azanylpyrimidin-4-yl)methoxy]pyridin-2-yl]-N-(3-bromophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[3-[(2-azanylpyrimidin-4-yl)methoxy]pyridin-2-yl]-N-(3-bromophenyl)piperazine-1-carboxamide Openeye Name: 4-[3-[(2-aminopyrimidin-4-yl)methoxy]-2-pyridyl]-N-(3-bromophenyl)piperazine-1-carboxamide CAS Name: 4-[3-[(2-amino-4-pyrimidinyl)methoxy]-2-pyridinyl]-N-(3-bromophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[3-[(2-aminopyrimidin-4-yl)methoxy]pyridin-2-yl]-N-(3-bromophenyl)piperazine-1-carboxamide Traditional Name: 4-[3-[(2-aminopyrimidin-4-yl)methoxy]-2-pyridyl]-N-(3-bromophenyl)piperazine-1-carboxamide Formula: C21H22BrN7O2 MolecularWeight: 484.34908

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)OCC3=NC(=NC=C3)N)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)OCC3=NC(=NC=C3)N)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H22BrN7O2/c22-15-3-1-4-16(13-15)27-21(30)29-11-9-28(10-12-29)19-18(5-2-7-24-19)31-14-17-6-8-25-20(23)26-17/h1-8,13H,9-12,14H2,(H,27,30)(H2,23,25,26)