4-[(4-fluorophenyl)methyl]-6-oxidanyl-1-(1-piperidin-1-ylpropyl)-3-(7H-purin-8-ylmethyl)benzimidazol-2-one

Systemtic Name: 4-[(4-fluorophenyl)methyl]-6-oxidanyl-1-(1-piperidin-1-ylpropyl)-3-(7H-purin-8-ylmethyl)benzimidazol-2-one Openeye Name: 4-[(4-fluorophenyl)methyl]-6-hydroxy-1-[1-(1-piperidyl)propyl]-3-(7H-purin-8-ylmethyl)benzimidazol-2-one CAS Name: 4-[(4-fluorophenyl)methyl]-6-hydroxy-1-[1-(1-piperidinyl)propyl]-3-(7H-purin-8-ylmethyl)-2-benzimidazolone IUPAC Name: 4-[(4-fluorophenyl)methyl]-6-hydroxy-1-(1-piperidin-1-ylpropyl)-3-(7H-purin-8-ylmethyl)benzimidazol-2-one Traditional Name: 4-(4-fluorobenzyl)-6-hydroxy-1-(1-piperidinopropyl)-3-(7H-purin-8-ylmethyl)benzimidazol-2-one Formula: C28H30FN7O2 MolecularWeight: 515.581903

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCCCC1)N2C3=C(C(=CC(=C3)O)CC4=CC=C(C=C4)F)N(C2=O)CC5=NC6=NC=NC=C6N5

Isomeric SMILES

CCC(N1CCCCC1)N2C3=C(C(=CC(=C3)O)CC4=CC=C(C=C4)F)N(C2=O)CC5=NC6=NC=NC=C6N5

InChI

InChI=1S/C28H30FN7O2/c1-2-25(34-10-4-3-5-11-34)36-23-14-21(37)13-19(12-18-6-8-20(29)9-7-18)26(23)35(28(36)38)16-24-32-22-15-30-17-31-27(22)33-24/h6-9,13-15,17,25,37H,2-5,10-12,16H2,1H3,(H,30,31,32,33)