1-[2-[(4-fluorophenyl)methyl]-1-[1-(pyrimidin-2-ylamino)ethyl]piperidin-4-yl]benzimidazol-2-amine

Systemtic Name: 1-[2-[(4-fluorophenyl)methyl]-1-[1-(pyrimidin-2-ylamino)ethyl]piperidin-4-yl]benzimidazol-2-amine Openeye Name: 1-[2-[(4-fluorophenyl)methyl]-1-[1-(pyrimidin-2-ylamino)ethyl]-4-piperidyl]benzimidazol-2-amine CAS Name: 1-[2-[(4-fluorophenyl)methyl]-1-[1-(2-pyrimidinylamino)ethyl]-4-piperidinyl]-2-benzimidazolamine IUPAC Name: 1-[2-[(4-fluorophenyl)methyl]-1-[1-(pyrimidin-2-ylamino)ethyl]piperidin-4-yl]benzimidazol-2-amine Traditional Name: 1-[4-(2-aminobenzimidazol-1-yl)-2-(4-fluorobenzyl)piperidino]ethyl-(2-pyrimidyl)amine Formula: C25H28FN7 MolecularWeight: 445.535123

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC1=NC=CC=N1)N2CCC(CC2CC3=CC=C(C=C3)F)N4C5=CC=CC=C5N=C4N

Isomeric SMILES

CC(NC1=NC=CC=N1)N2CCC(CC2CC3=CC=C(C=C3)F)N4C5=CC=CC=C5N=C4N

InChI

InChI=1S/C25H28FN7/c1-17(30-25-28-12-4-13-29-25)32-14-11-20(16-21(32)15-18-7-9-19(26)10-8-18)33-23-6-3-2-5-22(23)31-24(33)27/h2-10,12-13,17,20-21H,11,14-16H2,1H3,(H2,27,31)(H,28,29,30)