N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine hydrochloride

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine hydrochloride Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-amine hydrochloride CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(3-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinamine hydrochloride IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine hydrochloride Traditional Name: (4-chloro-2,5-dimethoxy-phenyl)-[2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amine hydrochloride Formula: C18H15Cl2F3N4O2 MolecularWeight: 447.23851

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3)OC)Cl.Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3)OC)Cl.Cl

InChI

InChI=1S/C18H14ClF3N4O2.ClH/c1-27-13-7-12(14(28-2)6-11(13)19)24-16-8-15(18(20,21)22)25-17(26-16)10-4-3-5-23-9-10;/h3-9H,1-2H3,(H,24,25,26);1H