2,4-diphenyl-5-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]pyrazol-3-amine

Systemtic Name: 2,4-diphenyl-5-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]pyrazol-3-amine Openeye Name: 5-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2,4-diphenyl-pyrazol-3-amine CAS Name: 2,4-diphenyl-5-[[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-3-pyrazolamine IUPAC Name: 5-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2,4-diphenylpyrazol-3-amine Traditional Name: [5-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2,4-diphenyl-pyrazol-3-yl]amine Formula: C27H31N5+2 MolecularWeight: 425.56854

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC3=NN(C(=C3C4=CC=CC=C4)N)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC3=NN(C(=C3C4=CC=CC=C4)N)C5=CC=CC=C5

InChI

InChI=1S/C27H29N5/c28-27-26(23-12-6-2-7-13-23)25(29-32(27)24-14-8-3-9-15-24)21-31-18-16-30(17-19-31)20-22-10-4-1-5-11-22/h1-15H,16-21,28H2/p+2