4-[2-(propan-2-ylamino)-6-(trifluoromethyl)pyrimidin-4-yl]oxybenzenecarbonitrile

Systemtic Name: 4-[2-(propan-2-ylamino)-6-(trifluoromethyl)pyrimidin-4-yl]oxybenzenecarbonitrile Openeye Name: 4-[2-(isopropylamino)-6-(trifluoromethyl)pyrimidin-4-yl]oxybenzonitrile CAS Name: 4-[[2-(propan-2-ylamino)-6-(trifluoromethyl)-4-pyrimidinyl]oxy]benzonitrile IUPAC Name: 4-[2-(propan-2-ylamino)-6-(trifluoromethyl)pyrimidin-4-yl]oxybenzonitrile Traditional Name: 4-[2-(isopropylamino)-6-(trifluoromethyl)pyrimidin-4-yl]oxybenzonitrile Formula: C15H13F3N4O MolecularWeight: 322.28513

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC(=CC(=N1)OC2=CC=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

CC(C)NC1=NC(=CC(=N1)OC2=CC=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C15H13F3N4O/c1-9(2)20-14-21-12(15(16,17)18)7-13(22-14)23-11-5-3-10(8-19)4-6-11/h3-7,9H,1-2H3,(H,20,21,22)