N,9-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-purin-2-amine

Systemtic Name: N,9-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-purin-2-amine Openeye Name: N,9-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-purin-2-amine CAS Name: N,9-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-2-purinamine IUPAC Name: N,9-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylpurin-2-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[9-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-purin-2-yl]amine Formula: C22H19N5O4 MolecularWeight: 417.41736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=N1)NC3=CC4=C(C=C3)OCCO4)N(C=N2)C5=CC6=C(C=C5)OCCO6

Isomeric SMILES

CC1=C2C(=NC(=N1)NC3=CC4=C(C=C3)OCCO4)N(C=N2)C5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C22H19N5O4/c1-13-20-21(27(12-23-20)15-3-5-17-19(11-15)31-9-7-29-17)26-22(24-13)25-14-2-4-16-18(10-14)30-8-6-28-16/h2-5,10-12H,6-9H2,1H3,(H,24,25,26)