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

Systemtic Name: 2-azanyl-4-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]methylamino]-6-(furan-2-yl)pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]methylamino]-6-(2-furyl)pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methylamino]-6-(2-furanyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methylamino]-6-(furan-2-yl)pyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]methylamino]-6-(2-furyl)pyrimidine-5-carbonitrile Formula: C16H10ClF3N6O MolecularWeight: 394.73841

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C(C(=NC(=N2)N)NCC3=C(C=C(C=N3)C(F)(F)F)Cl)C#N

Isomeric SMILES

C1=COC(=C1)C2=C(C(=NC(=N2)N)NCC3=C(C=C(C=N3)C(F)(F)F)Cl)C#N

InChI

InChI=1S/C16H10ClF3N6O/c17-10-4-8(16(18,19)20)6-23-11(10)7-24-14-9(5-21)13(25-15(22)26-14)12-2-1-3-27-12/h1-4,6H,7H2,(H3,22,24,25,26)