1-[(4-fluorophenyl)methyl]-4-[2-methyl-5-nitro-3-(phenylmethyl)imidazol-4-yl]piperazine

Systemtic Name: 1-[(4-fluorophenyl)methyl]-4-[2-methyl-5-nitro-3-(phenylmethyl)imidazol-4-yl]piperazine Openeye Name: 1-(3-benzyl-2-methyl-5-nitro-imidazol-4-yl)-4-[(4-fluorophenyl)methyl]piperazine CAS Name: 1-[(4-fluorophenyl)methyl]-4-[2-methyl-5-nitro-3-(phenylmethyl)-4-imidazolyl]piperazine IUPAC Name: 1-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)-4-[(4-fluorophenyl)methyl]piperazine Traditional Name: 1-(3-benzyl-2-methyl-5-nitro-imidazol-4-yl)-4-(4-fluorobenzyl)piperazine Formula: C22H24FN5O2 MolecularWeight: 409.456663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC2=CC=CC=C2)N3CCN(CC3)CC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CC2=CC=CC=C2)N3CCN(CC3)CC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C22H24FN5O2/c1-17-24-21(28(29)30)22(27(17)16-18-5-3-2-4-6-18)26-13-11-25(12-14-26)15-19-7-9-20(23)10-8-19/h2-10H,11-16H2,1H3