N2-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-7H-purine-2,6-diamine

Systemtic Name: N2-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-7H-purine-2,6-diamine Openeye Name: N2-[2-(3,4-dimethoxyphenyl)ethyl]-8-(2-furyl)-7H-purine-2,6-diamine CAS Name: N2-[2-(3,4-dimethoxyphenyl)ethyl]-8-(2-furanyl)-7H-purine-2,6-diamine IUPAC Name: 2-N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-7H-purine-2,6-diamine Traditional Name: [6-amino-8-(2-furyl)-7H-purin-2-yl]-homoveratryl-amine Formula: C19H20N6O3 MolecularWeight: 380.4005

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC3=C(C(=N2)N)NC(=N3)C4=CC=CO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC3=C(C(=N2)N)NC(=N3)C4=CC=CO4)OC

InChI

InChI=1S/C19H20N6O3/c1-26-12-6-5-11(10-14(12)27-2)7-8-21-19-23-16(20)15-18(25-19)24-17(22-15)13-4-3-9-28-13/h3-6,9-10H,7-8H2,1-2H3,(H4,20,21,22,23,24,25)