N2,N4,N6-tris(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4,6-triamine

Systemtic Name: N2,N4,N6-tris(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4,6-triamine Openeye Name: N2,N4,N6-tris(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4,6-triamine CAS Name: N2,N4,N6-tris(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4,6-triamine IUPAC Name: 2-N,4-N,6-N-tris(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4,6-triamine Traditional Name: [2,6-bis(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-4-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)amine Formula: C28H25N5O6 MolecularWeight: 527.528

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=CC(=NC(=N3)NC4=CC5=C(C=C4)OCCO5)NC6=CC7=C(C=C6)OCCO7

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=CC(=NC(=N3)NC4=CC5=C(C=C4)OCCO5)NC6=CC7=C(C=C6)OCCO7

InChI

InChI=1S/C28H25N5O6/c1-4-20-23(37-10-7-34-20)13-17(1)29-26-16-27(30-18-2-5-21-24(14-18)38-11-8-35-21)33-28(32-26)31-19-3-6-22-25(15-19)39-12-9-36-22/h1-6,13-16H,7-12H2,(H3,29,30,31,32,33)