2-(diethylaminomethyl)-4-[[9-[5-(diethylamino)pentan-2-yl]purin-6-yl]amino]phenol

Systemtic Name: 2-(diethylaminomethyl)-4-[[9-[5-(diethylamino)pentan-2-yl]purin-6-yl]amino]phenol Openeye Name: 2-(diethylaminomethyl)-4-[[9-[4-(diethylamino)-1-methyl-butyl]purin-6-yl]amino]phenol CAS Name: 2-(diethylaminomethyl)-4-[[9-[5-(diethylamino)pentan-2-yl]-6-purinyl]amino]phenol IUPAC Name: 2-(diethylaminomethyl)-4-[[9-[5-(diethylamino)pentan-2-yl]purin-6-yl]amino]phenol Traditional Name: 2-(diethylaminomethyl)-4-[[9-[4-(diethylamino)-1-methyl-butyl]purin-6-yl]amino]phenol Formula: C25H39N7O MolecularWeight: 453.62346

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)N1C=NC2=C1N=CN=C2NC3=CC(=C(C=C3)O)CN(CC)CC

Isomeric SMILES

CCN(CC)CCCC(C)N1C=NC2=C1N=CN=C2NC3=CC(=C(C=C3)O)CN(CC)CC

InChI

InChI=1S/C25H39N7O/c1-6-30(7-2)14-10-11-19(5)32-18-28-23-24(26-17-27-25(23)32)29-21-12-13-22(33)20(15-21)16-31(8-3)9-4/h12-13,15,17-19,33H,6-11,14,16H2,1-5H3,(H,26,27,29)