N2-(2-azanylethyl)-N6-[(4-methoxyphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine

Systemtic Name: N2-(2-azanylethyl)-N6-[(4-methoxyphenyl)methyl]-9-propan-2-yl-purine-2,6-diamine Openeye Name: N2-(2-aminoethyl)-9-isopropyl-N6-[(4-methoxyphenyl)methyl]purine-2,6-diamine CAS Name: N2-(2-aminoethyl)-N6-[(4-methoxyphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-(2-aminoethyl)-6-N-[(4-methoxyphenyl)methyl]-9-propan-2-ylpurine-2,6-diamine Traditional Name: 2-aminoethyl-[9-isopropyl-6-(p-anisylamino)purin-2-yl]amine Formula: C18H25N7O MolecularWeight: 355.4374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)NCCN

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)NCCN

InChI

InChI=1S/C18H25N7O/c1-12(2)25-11-22-15-16(23-18(20-9-8-19)24-17(15)25)21-10-13-4-6-14(26-3)7-5-13/h4-7,11-12H,8-10,19H2,1-3H3,(H2,20,21,23,24)