N-[1-(2-azanylethyl)azepan-4-yl]-1-[(4-fluorophenyl)methyl]benzimidazol-2-amine

Systemtic Name: N-[1-(2-azanylethyl)azepan-4-yl]-1-[(4-fluorophenyl)methyl]benzimidazol-2-amine Openeye Name: N-[1-(2-aminoethyl)azepan-4-yl]-1-[(4-fluorophenyl)methyl]benzimidazol-2-amine CAS Name: N-[1-(2-aminoethyl)-4-azepanyl]-1-[(4-fluorophenyl)methyl]-2-benzimidazolamine IUPAC Name: N-[1-(2-aminoethyl)azepan-4-yl]-1-[(4-fluorophenyl)methyl]benzimidazol-2-amine Traditional Name: [1-(2-aminoethyl)azepan-4-yl]-[1-(4-fluorobenzyl)benzimidazol-2-yl]amine Formula: C22H28FN5 MolecularWeight: 381.489623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)CCN)NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F

Isomeric SMILES

C1CC(CCN(C1)CCN)NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H28FN5/c23-18-9-7-17(8-10-18)16-28-21-6-2-1-5-20(21)26-22(28)25-19-4-3-13-27(14-11-19)15-12-24/h1-2,5-10,19H,3-4,11-16,24H2,(H,25,26)