N-(2-chloranyl-5-methoxy-phenyl)-2-pyrimidin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine hydrochloride

Systemtic Name: N-(2-chloranyl-5-methoxy-phenyl)-2-pyrimidin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine hydrochloride Openeye Name: N-(2-chloro-5-methoxy-phenyl)-2-pyrimidin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine hydrochloride CAS Name: N-(2-chloro-5-methoxyphenyl)-2-(2-pyrimidinyl)-6-(trifluoromethyl)-4-pyrimidinamine hydrochloride IUPAC Name: N-(2-chloro-5-methoxyphenyl)-2-pyrimidin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine hydrochloride Traditional Name: (2-chloro-5-methoxy-phenyl)-[2-(2-pyrimidyl)-6-(trifluoromethyl)pyrimidin-4-yl]amine hydrochloride Formula: C16H12Cl2F3N5O MolecularWeight: 418.20059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)NC2=NC(=NC(=C2)C(F)(F)F)C3=NC=CC=N3.Cl

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)NC2=NC(=NC(=C2)C(F)(F)F)C3=NC=CC=N3.Cl

InChI

InChI=1S/C16H11ClF3N5O.ClH/c1-26-9-3-4-10(17)11(7-9)23-13-8-12(16(18,19)20)24-15(25-13)14-21-5-2-6-22-14;/h2-8H,1H3,(H,23,24,25);1H