3-[[6-[(4-methoxyphenyl)methylamino]-8-(3-oxidanylpropylamino)-9-propan-2-yl-purin-2-yl]amino]propan-1-ol

Systemtic Name: 3-[[6-[(4-methoxyphenyl)methylamino]-8-(3-oxidanylpropylamino)-9-propan-2-yl-purin-2-yl]amino]propan-1-ol Openeye Name: 3-[[8-(3-hydroxypropylamino)-9-isopropyl-6-[(4-methoxyphenyl)methylamino]purin-2-yl]amino]propan-1-ol CAS Name: 3-[[8-(3-hydroxypropylamino)-6-[(4-methoxyphenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]-1-propanol IUPAC Name: 3-[[8-(3-hydroxypropylamino)-6-[(4-methoxyphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]propan-1-ol Traditional Name: 3-[[8-(3-hydroxypropylamino)-9-isopropyl-6-(p-anisylamino)purin-2-yl]amino]propan-1-ol Formula: C22H33N7O3 MolecularWeight: 443.54252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=NC(=N2)NCCCO)NCC3=CC=C(C=C3)OC)N=C1NCCCO

Isomeric SMILES

CC(C)N1C2=C(C(=NC(=N2)NCCCO)NCC3=CC=C(C=C3)OC)N=C1NCCCO

InChI

InChI=1S/C22H33N7O3/c1-15(2)29-20-18(26-22(29)24-11-5-13-31)19(27-21(28-20)23-10-4-12-30)25-14-16-6-8-17(32-3)9-7-16/h6-9,15,30-31H,4-5,10-14H2,1-3H3,(H,24,26)(H2,23,25,27,28)