2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine

Systemtic Name: 2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine Openeye Name: 2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine CAS Name: 2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]-1-piperazin-4-iumyl]pyrazine IUPAC Name: 2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine Traditional Name: 2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine Formula: C24H25N6+ MolecularWeight: 397.4955

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4)C5=NC=CN=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4)C5=NC=CN=C5

InChI

InChI=1S/C24H24N6/c1-2-4-19(5-3-1)20-6-8-21(9-7-20)24-22(16-27-28-24)18-29-12-14-30(15-13-29)23-17-25-10-11-26-23/h1-11,16-17H,12-15,18H2,(H,27,28)/p+1