8-ethyl-9-[4-(4-fluorophenyl)-1-methyl-benzimidazol-2-yl]-7-(2-methylpiperidin-1-yl)-8H-purin-6-amine

Systemtic Name: 8-ethyl-9-[4-(4-fluorophenyl)-1-methyl-benzimidazol-2-yl]-7-(2-methylpiperidin-1-yl)-8H-purin-6-amine Openeye Name: 8-ethyl-9-[4-(4-fluorophenyl)-1-methyl-benzimidazol-2-yl]-7-(2-methyl-1-piperidyl)-8H-purin-6-amine CAS Name: 8-ethyl-9-[4-(4-fluorophenyl)-1-methyl-2-benzimidazolyl]-7-(2-methyl-1-piperidinyl)-8H-purin-6-amine IUPAC Name: 8-ethyl-9-[4-(4-fluorophenyl)-1-methylbenzimidazol-2-yl]-7-(2-methylpiperidin-1-yl)-8H-purin-6-amine Traditional Name: [8-ethyl-9-[4-(4-fluorophenyl)-1-methyl-benzimidazol-2-yl]-7-(2-methylpiperidino)-8H-purin-6-yl]amine Formula: C27H31FN8 MolecularWeight: 486.587043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1N(C2=C(N1C3=NC4=C(C=CC=C4N3C)C5=CC=C(C=C5)F)N=CN=C2N)N6CCCCC6C

Isomeric SMILES

CCC1N(C2=C(N1C3=NC4=C(C=CC=C4N3C)C5=CC=C(C=C5)F)N=CN=C2N)N6CCCCC6C

InChI

InChI=1S/C27H31FN8/c1-4-22-35(26-24(25(29)30-16-31-26)36(22)34-15-6-5-8-17(34)2)27-32-23-20(9-7-10-21(23)33(27)3)18-11-13-19(28)14-12-18/h7,9-14,16-17,22H,4-6,8,15H2,1-3H3,(H2,29,30,31)