3-[9-(4-methylphenyl)-6-morpholin-4-yl-purin-2-yl]phenol

Systemtic Name: 3-[9-(4-methylphenyl)-6-morpholin-4-yl-purin-2-yl]phenol Openeye Name: 3-[6-morpholino-9-(p-tolyl)purin-2-yl]phenol CAS Name: 3-[9-(4-methylphenyl)-6-(4-morpholinyl)-2-purinyl]phenol IUPAC Name: 3-[9-(4-methylphenyl)-6-morpholin-4-ylpurin-2-yl]phenol Traditional Name: 3-[6-morpholino-9-(p-tolyl)purin-2-yl]phenol Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NC3=C2N=C(N=C3N4CCOCC4)C5=CC(=CC=C5)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NC3=C2N=C(N=C3N4CCOCC4)C5=CC(=CC=C5)O

InChI

InChI=1S/C22H21N5O2/c1-15-5-7-17(8-6-15)27-14-23-19-21(26-9-11-29-12-10-26)24-20(25-22(19)27)16-3-2-4-18(28)13-16/h2-8,13-14,28H,9-12H2,1H3