2-chloranyl-5-fluoranyl-N-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)pyrimidin-4-amine

Systemtic Name: 2-chloranyl-5-fluoranyl-N-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)pyrimidin-4-amine Openeye Name: 2-chloro-5-fluoro-N-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)pyrimidin-4-amine CAS Name: 2-chloro-5-fluoro-N-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)-4-pyrimidinamine IUPAC Name: 2-chloro-5-fluoro-N-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)pyrimidin-4-amine Traditional Name: (2-chloro-5-fluoro-pyrimidin-4-yl)-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)amine Formula: C13H11ClFN3O2 MolecularWeight: 295.696743

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=C(C=C2)NC3=NC(=NC=C3F)Cl)OO1

Isomeric SMILES

CC1CC2=C(C=C(C=C2)NC3=NC(=NC=C3F)Cl)OO1

InChI

InChI=1S/C13H11ClFN3O2/c1-7-4-8-2-3-9(5-11(8)20-19-7)17-12-10(15)6-16-13(14)18-12/h2-3,5-7H,4H2,1H3,(H,16,17,18)