N2-methyl-N2-(1-methylpiperidin-4-yl)-N6-(4-morpholin-4-ylphenyl)-9-thiophen-3-yl-purine-2,6-diamine

Systemtic Name: N2-methyl-N2-(1-methylpiperidin-4-yl)-N6-(4-morpholin-4-ylphenyl)-9-thiophen-3-yl-purine-2,6-diamine Openeye Name: N2-methyl-N2-(1-methyl-4-piperidyl)-N6-(4-morpholinophenyl)-9-(3-thienyl)purine-2,6-diamine CAS Name: N2-methyl-N2-(1-methyl-4-piperidinyl)-N6-[4-(4-morpholinyl)phenyl]-9-(3-thiophenyl)purine-2,6-diamine IUPAC Name: 2-N-methyl-2-N-(1-methylpiperidin-4-yl)-6-N-(4-morpholin-4-ylphenyl)-9-thiophen-3-ylpurine-2,6-diamine Traditional Name: methyl-(1-methyl-4-piperidyl)-[6-(4-morpholinoanilino)-9-(3-thienyl)purin-2-yl]amine Formula: C26H32N8OS MolecularWeight: 504.65028

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=NC3=C(C(=N2)NC4=CC=C(C=C4)N5CCOCC5)N=CN3C6=CSC=C6

Isomeric SMILES

CN1CCC(CC1)N(C)C2=NC3=C(C(=N2)NC4=CC=C(C=C4)N5CCOCC5)N=CN3C6=CSC=C6

InChI

InChI=1S/C26H32N8OS/c1-31-10-7-20(8-11-31)32(2)26-29-24(23-25(30-26)34(18-27-23)22-9-16-36-17-22)28-19-3-5-21(6-4-19)33-12-14-35-15-13-33/h3-6,9,16-18,20H,7-8,10-15H2,1-2H3,(H,28,29,30)