3-[[2-pyridin-4-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]phenol hydrochloride

Systemtic Name: 3-[[2-pyridin-4-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]phenol hydrochloride Openeye Name: 3-[[2-(4-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amino]phenol hydrochloride CAS Name: 3-[[2-pyridin-4-yl-6-(trifluoromethyl)-4-pyrimidinyl]amino]phenol hydrochloride IUPAC Name: 3-[[2-pyridin-4-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]phenol hydrochloride Traditional Name: 3-[[2-(4-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amino]phenol hydrochloride Formula: C16H12ClF3N4O MolecularWeight: 368.74089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)NC2=NC(=NC(=C2)C(F)(F)F)C3=CC=NC=C3.Cl

Isomeric SMILES

C1=CC(=CC(=C1)O)NC2=NC(=NC(=C2)C(F)(F)F)C3=CC=NC=C3.Cl

InChI

InChI=1S/C16H11F3N4O.ClH/c17-16(18,19)13-9-14(21-11-2-1-3-12(24)8-11)23-15(22-13)10-4-6-20-7-5-10;/h1-9,24H,(H,21,22,23);1H