4-[3-[(2-azanylpyrimidin-4-yl)methoxy]pyridin-2-yl]-N-(3-bromanyl-5-ethyl-phenyl)piperazine-1-carboxamide

Systemtic Name: 4-[3-[(2-azanylpyrimidin-4-yl)methoxy]pyridin-2-yl]-N-(3-bromanyl-5-ethyl-phenyl)piperazine-1-carboxamide Openeye Name: 4-[3-[(2-aminopyrimidin-4-yl)methoxy]-2-pyridyl]-N-(3-bromo-5-ethyl-phenyl)piperazine-1-carboxamide CAS Name: 4-[3-[(2-amino-4-pyrimidinyl)methoxy]-2-pyridinyl]-N-(3-bromo-5-ethylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[3-[(2-aminopyrimidin-4-yl)methoxy]pyridin-2-yl]-N-(3-bromo-5-ethylphenyl)piperazine-1-carboxamide Traditional Name: 4-[3-[(2-aminopyrimidin-4-yl)methoxy]-2-pyridyl]-N-(3-bromo-5-ethyl-phenyl)piperazine-1-carboxamide Formula: C23H26BrN7O2 MolecularWeight: 512.40224

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1)Br)NC(=O)N2CCN(CC2)C3=C(C=CC=N3)OCC4=NC(=NC=C4)N

Isomeric SMILES

CCC1=CC(=CC(=C1)Br)NC(=O)N2CCN(CC2)C3=C(C=CC=N3)OCC4=NC(=NC=C4)N

InChI

InChI=1S/C23H26BrN7O2/c1-2-16-12-17(24)14-19(13-16)29-23(32)31-10-8-30(9-11-31)21-20(4-3-6-26-21)33-15-18-5-7-27-22(25)28-18/h3-7,12-14H,2,8-11,15H2,1H3,(H,29,32)(H2,25,27,28)