4-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: 4-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-2-amine Openeye Name: 4-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)-6-(trifluoromethyl)pyrimidin-2-amine CAS Name: 4-(3,4-dimethoxyphenyl)-N-(2-furanylmethyl)-6-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: 4-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-(2-furfuryl)amine Formula: C18H16F3N3O3 MolecularWeight: 379.33315

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NC(=N2)NCC3=CC=CO3)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NC(=N2)NCC3=CC=CO3)C(F)(F)F)OC

InChI

InChI=1S/C18H16F3N3O3/c1-25-14-6-5-11(8-15(14)26-2)13-9-16(18(19,20)21)24-17(23-13)22-10-12-4-3-7-27-12/h3-9H,10H2,1-2H3,(H,22,23,24)