2-[[6-[(4-methoxyphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]propane-1,2-diol

Systemtic Name: 2-[[6-[(4-methoxyphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]propane-1,2-diol Openeye Name: 2-[[9-isopropyl-6-[(4-methoxyphenyl)methylamino]purin-2-yl]amino]propane-1,2-diol CAS Name: 2-[[6-[(4-methoxyphenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]propane-1,2-diol IUPAC Name: 2-[[6-[(4-methoxyphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]propane-1,2-diol Traditional Name: 2-[[9-isopropyl-6-(p-anisylamino)purin-2-yl]amino]propane-1,2-diol Formula: C19H26N6O3 MolecularWeight: 386.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)NC(C)(CO)O

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)NC(C)(CO)O

InChI

InChI=1S/C19H26N6O3/c1-12(2)25-11-21-15-16(20-9-13-5-7-14(28-4)8-6-13)22-18(23-17(15)25)24-19(3,27)10-26/h5-8,11-12,26-27H,9-10H2,1-4H3,(H2,20,22,23,24)