2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoranyl-pyrimidin-2-yl]amino]ethanol

Systemtic Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoranyl-pyrimidin-2-yl]amino]ethanol Openeye Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoro-pyrimidin-2-yl]amino]ethanol CAS Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoro-2-pyrimidinyl]amino]ethanol IUPAC Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoropyrimidin-2-yl]amino]ethanol Traditional Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoro-pyrimidin-2-yl]amino]ethanol Formula: C14H15FN4O3 MolecularWeight: 306.292303

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NCCO

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NCCO

InChI

InChI=1S/C14H15FN4O3/c15-10-8-17-14(16-3-4-20)19-13(10)18-9-1-2-11-12(7-9)22-6-5-21-11/h1-2,7-8,20H,3-6H2,(H2,16,17,18,19)