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

Systemtic Name: 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoranyl-pyrimidin-2-yl]amino]phenol Openeye Name: 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoro-pyrimidin-2-yl]amino]phenol CAS Name: 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoro-2-pyrimidinyl]amino]phenol IUPAC Name: 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoropyrimidin-2-yl]amino]phenol Traditional Name: 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-fluoro-pyrimidin-2-yl]amino]phenol Formula: C18H15FN4O3 MolecularWeight: 354.335103

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC(=CC=C4)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC(=CC=C4)O

InChI

InChI=1S/C18H15FN4O3/c19-14-10-20-18(22-11-2-1-3-13(24)8-11)23-17(14)21-12-4-5-15-16(9-12)26-7-6-25-15/h1-5,8-10,24H,6-7H2,(H2,20,21,22,23)