4-[2-(4-bromophenyl)-6-morpholin-4-yl-pyrimidin-4-yl]oxybenzenecarbonitrile

Systemtic Name: 4-[2-(4-bromophenyl)-6-morpholin-4-yl-pyrimidin-4-yl]oxybenzenecarbonitrile Openeye Name: 4-[2-(4-bromophenyl)-6-morpholino-pyrimidin-4-yl]oxybenzonitrile CAS Name: 4-[[2-(4-bromophenyl)-6-(4-morpholinyl)-4-pyrimidinyl]oxy]benzonitrile IUPAC Name: 4-[2-(4-bromophenyl)-6-morpholin-4-ylpyrimidin-4-yl]oxybenzonitrile Traditional Name: 4-[2-(4-bromophenyl)-6-morpholino-pyrimidin-4-yl]oxybenzonitrile Formula: C21H17BrN4O2 MolecularWeight: 437.28928

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=NC(=N2)C3=CC=C(C=C3)Br)OC4=CC=C(C=C4)C#N

Isomeric SMILES

C1COCCN1C2=CC(=NC(=N2)C3=CC=C(C=C3)Br)OC4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H17BrN4O2/c22-17-5-3-16(4-6-17)21-24-19(26-9-11-27-12-10-26)13-20(25-21)28-18-7-1-15(14-23)2-8-18/h1-8,13H,9-12H2