1-[6-[(4-chlorophenyl)amino]purin-9-yl]-3-(diethylamino)propan-2-ol

Systemtic Name: 1-[6-[(4-chlorophenyl)amino]purin-9-yl]-3-(diethylamino)propan-2-ol Openeye Name: 1-[6-(4-chloroanilino)purin-9-yl]-3-(diethylamino)propan-2-ol CAS Name: 1-[6-(4-chloroanilino)-9-purinyl]-3-(diethylamino)-2-propanol IUPAC Name: 1-[6-(4-chloroanilino)purin-9-yl]-3-(diethylamino)propan-2-ol Traditional Name: 1-[6-(4-chloroanilino)purin-9-yl]-3-(diethylamino)propan-2-ol Formula: C18H23ClN6O MolecularWeight: 374.86782

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CN1C=NC2=C1N=CN=C2NC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCN(CC)CC(CN1C=NC2=C1N=CN=C2NC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C18H23ClN6O/c1-3-24(4-2)9-15(26)10-25-12-22-16-17(20-11-21-18(16)25)23-14-7-5-13(19)6-8-14/h5-8,11-12,15,26H,3-4,9-10H2,1-2H3,(H,20,21,23)