8-[[(3,4,5-trimethoxyphenyl)amino]methyl]-7H-purine-2,6-diamine

Systemtic Name: 8-[[(3,4,5-trimethoxyphenyl)amino]methyl]-7H-purine-2,6-diamine Openeye Name: 8-[(3,4,5-trimethoxyanilino)methyl]-7H-purine-2,6-diamine CAS Name: 8-[(3,4,5-trimethoxyanilino)methyl]-7H-purine-2,6-diamine IUPAC Name: 8-[(3,4,5-trimethoxyanilino)methyl]-7H-purine-2,6-diamine Traditional Name: (2,6-diamino-7H-purin-8-yl)methyl-(3,4,5-trimethoxyphenyl)amine Formula: C15H19N7O3 MolecularWeight: 345.35646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NCC2=NC3=C(N2)C(=NC(=N3)N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NCC2=NC3=C(N2)C(=NC(=N3)N)N

InChI

InChI=1S/C15H19N7O3/c1-23-8-4-7(5-9(24-2)12(8)25-3)18-6-10-19-11-13(16)21-15(17)22-14(11)20-10/h4-5,18H,6H2,1-3H3,(H5,16,17,19,20,21,22)