N6-[1-[(4-dimethylaminophenyl)methyl]piperidin-4-yl]-N2-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine

Systemtic Name: N6-[1-[(4-dimethylaminophenyl)methyl]piperidin-4-yl]-N2-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine Openeye Name: N6-[1-[(4-dimethylaminophenyl)methyl]-4-piperidyl]-N2-(4-morpholinophenyl)-7H-purine-2,6-diamine CAS Name: N6-[1-[(4-dimethylaminophenyl)methyl]-4-piperidinyl]-N2-[4-(4-morpholinyl)phenyl]-7H-purine-2,6-diamine IUPAC Name: 6-N-[1-[(4-dimethylaminophenyl)methyl]piperidin-4-yl]-2-N-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine Traditional Name: dimethyl-[4-[[4-[[2-(4-morpholinoanilino)-7H-purin-6-yl]amino]piperidino]methyl]phenyl]amine Formula: C29H37N9O MolecularWeight: 527.66378

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN2CCC(CC2)NC3=NC(=NC4=C3NC=N4)NC5=CC=C(C=C5)N6CCOCC6

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN2CCC(CC2)NC3=NC(=NC4=C3NC=N4)NC5=CC=C(C=C5)N6CCOCC6

InChI

InChI=1S/C29H37N9O/c1-36(2)24-7-3-21(4-8-24)19-37-13-11-23(12-14-37)32-28-26-27(31-20-30-26)34-29(35-28)33-22-5-9-25(10-6-22)38-15-17-39-18-16-38/h3-10,20,23H,11-19H2,1-2H3,(H3,30,31,32,33,34,35)