2-[2-[[6-[5-cyano-2-(dimethylamino)phenoxy]-8-ethyl-7H-purin-2-yl]oxy]phenyl]guanidine

Systemtic Name: 2-[2-[[6-[5-cyano-2-(dimethylamino)phenoxy]-8-ethyl-7H-purin-2-yl]oxy]phenyl]guanidine Openeye Name: 2-[2-[[6-[5-cyano-2-(dimethylamino)phenoxy]-8-ethyl-7H-purin-2-yl]oxy]phenyl]guanidine CAS Name: 2-[2-[[6-[5-cyano-2-(dimethylamino)phenoxy]-8-ethyl-7H-purin-2-yl]oxy]phenyl]guanidine IUPAC Name: 2-[2-[[6-[5-cyano-2-(dimethylamino)phenoxy]-8-ethyl-7H-purin-2-yl]oxy]phenyl]guanidine Traditional Name: 2-[2-[[6-[5-cyano-2-(dimethylamino)phenoxy]-8-ethyl-7H-purin-2-yl]oxy]phenyl]guanidine Formula: C23H23N9O2 MolecularWeight: 457.48782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC=C3N=C(N)N)OC4=C(C=CC(=C4)C#N)N(C)C

Isomeric SMILES

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC=C3N=C(N)N)OC4=C(C=CC(=C4)C#N)N(C)C

InChI

InChI=1S/C23H23N9O2/c1-4-18-28-19-20(29-18)30-23(34-16-8-6-5-7-14(16)27-22(25)26)31-21(19)33-17-11-13(12-24)9-10-15(17)32(2)3/h5-11H,4H2,1-3H3,(H4,25,26,27)(H,28,29,30,31)