1-(4-fluorophenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine; methanesulfonic acid

Systemtic Name: 1-(4-fluorophenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine; methanesulfonic acid Openeye Name: 1-(4-fluorophenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine; methanesulfonic acid CAS Name: 1-(4-fluorophenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine; methanesulfonic acid IUPAC Name: 1-(4-fluorophenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine; methanesulfonic acid Traditional Name: 1-(4-fluorophenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine; mesylic acid Formula: C22H29FN4O6S2 MolecularWeight: 528.617263

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CC2=CN=C(N2)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CC2=CN=C(N2)C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN4.2CH4O3S/c21-17-6-8-19(9-7-17)25-12-10-24(11-13-25)15-18-14-22-20(23-18)16-4-2-1-3-5-16;2*1-5(2,3)4/h1-9,14H,10-13,15H2,(H,22,23);2*1H3,(H,2,3,4)