N2,N4-bis(1,3-benzodioxol-5-yl)-5-fluoranyl-pyrimidine-2,4-diamine

Systemtic Name: N2,N4-bis(1,3-benzodioxol-5-yl)-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis(1,3-benzodioxol-5-yl)-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis(1,3-benzodioxol-5-yl)-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis(1,3-benzodioxol-5-yl)-5-fluoropyrimidine-2,4-diamine Traditional Name: 1,3-benzodioxol-5-yl-[2-(1,3-benzodioxol-5-ylamino)-5-fluoro-pyrimidin-4-yl]amine Formula: C18H13FN4O4 MolecularWeight: 368.318623

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC=C3F)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC=C3F)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C18H13FN4O4/c19-12-7-20-18(22-11-2-4-14-16(6-11)27-9-25-14)23-17(12)21-10-1-3-13-15(5-10)26-8-24-13/h1-7H,8-9H2,(H2,20,21,22,23)