5-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-N-(4-methylcyclohexyl)pyrimidin-2-amine

Systemtic Name: 5-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-N-(4-methylcyclohexyl)pyrimidin-2-amine Openeye Name: 5-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(4-methylcyclohexyl)pyrimidin-2-amine CAS Name: 5-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(4-methylcyclohexyl)-2-pyrimidinamine IUPAC Name: 5-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(4-methylcyclohexyl)pyrimidin-2-amine Traditional Name: [5-(2,2-difluoro-1,3-benzodioxol-4-yl)pyrimidin-2-yl]-(4-methylcyclohexyl)amine Formula: C18H19F2N3O2 MolecularWeight: 347.359166

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC2=NC=C(C=N2)C3=C4C(=CC=C3)OC(O4)(F)F

Isomeric SMILES

CC1CCC(CC1)NC2=NC=C(C=N2)C3=C4C(=CC=C3)OC(O4)(F)F

InChI

InChI=1S/C18H19F2N3O2/c1-11-5-7-13(8-6-11)23-17-21-9-12(10-22-17)14-3-2-4-15-16(14)25-18(19,20)24-15/h2-4,9-11,13H,5-8H2,1H3,(H,21,22,23)