2-azanyl-4-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]methyl]-6-(4-methylfuran-2-yl)pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]methyl]-6-(4-methylfuran-2-yl)pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]methyl]-6-(4-methyl-2-furyl)pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-6-(4-methyl-2-furanyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]-6-(4-methylfuran-2-yl)pyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]methyl]-6-(4-methyl-2-furyl)pyrimidine-5-carbonitrile Formula: C17H11ClF3N5O MolecularWeight: 393.75035

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC(=C1)C2=C(C(=NC(=N2)N)CC3=C(C=C(C=N3)C(F)(F)F)Cl)C#N

Isomeric SMILES

CC1=COC(=C1)C2=C(C(=NC(=N2)N)CC3=C(C=C(C=N3)C(F)(F)F)Cl)C#N

InChI

InChI=1S/C17H11ClF3N5O/c1-8-2-14(27-7-8)15-10(5-22)12(25-16(23)26-15)4-13-11(18)3-9(6-24-13)17(19,20)21/h2-3,6-7H,4H2,1H3,(H2,23,25,26)