4-[2-[4-[2-(4-ethylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]ethoxy]-2-fluoranyl-aniline

Systemtic Name: 4-[2-[4-[2-(4-ethylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]ethoxy]-2-fluoranyl-aniline Openeye Name: 4-[2-[4-[2-(4-ethylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]ethoxy]-2-fluoro-aniline CAS Name: 4-[2-[4-[2-(4-ethylphenyl)-1H-benzimidazol-4-yl]-1-piperazinyl]ethoxy]-2-fluoroaniline IUPAC Name: 4-[2-[4-[2-(4-ethylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]ethoxy]-2-fluoroaniline Traditional Name: [4-[2-[4-[2-(4-ethylphenyl)-1H-benzimidazol-4-yl]piperazino]ethoxy]-2-fluoro-phenyl]amine Formula: C27H30FN5O MolecularWeight: 459.558403

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(N2)C=CC=C3N4CCN(CC4)CCOC5=CC(=C(C=C5)N)F

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(N2)C=CC=C3N4CCN(CC4)CCOC5=CC(=C(C=C5)N)F

InChI

InChI=1S/C27H30FN5O/c1-2-19-6-8-20(9-7-19)27-30-24-4-3-5-25(26(24)31-27)33-14-12-32(13-15-33)16-17-34-21-10-11-23(29)22(28)18-21/h3-11,18H,2,12-17,29H2,1H3,(H,30,31)