1-[3-(1H-benzimidazol-2-yl)-4-[(4-fluorophenyl)methyl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[3-(1H-benzimidazol-2-yl)-4-[(4-fluorophenyl)methyl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[3-(1H-benzimidazol-2-yl)-4-[(4-fluorophenyl)methyl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[3-(1H-benzimidazol-2-yl)-4-[(4-fluorophenyl)methyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[3-(1H-benzimidazol-2-yl)-4-[(4-fluorophenyl)methyl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[3-(1H-benzimidazol-2-yl)-4-(4-fluorobenzyl)piperazino]-3-methyl-butan-1-one Formula: C23H27FN4O MolecularWeight: 394.485083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(C(C1)C2=NC3=CC=CC=C3N2)CC4=CC=C(C=C4)F

Isomeric SMILES

CC(C)CC(=O)N1CCN(C(C1)C2=NC3=CC=CC=C3N2)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H27FN4O/c1-16(2)13-22(29)28-12-11-27(14-17-7-9-18(24)10-8-17)21(15-28)23-25-19-5-3-4-6-20(19)26-23/h3-10,16,21H,11-15H2,1-2H3,(H,25,26)