2-[4-[[1-(phenylmethyl)pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine

Systemtic Name: 2-[4-[[1-(phenylmethyl)pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine Openeye Name: 2-[4-[(1-benzylpyrazol-4-yl)methyl]piperazin-4-ium-1-yl]pyrazine CAS Name: 2-[4-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-1-piperazin-4-iumyl]pyrazine IUPAC Name: 2-[4-[(1-benzylpyrazol-4-yl)methyl]piperazin-4-ium-1-yl]pyrazine Traditional Name: 2-[4-[(1-benzylpyrazol-4-yl)methyl]piperazin-4-ium-1-yl]pyrazine Formula: C19H23N6+ MolecularWeight: 335.42612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN(N=C2)CC3=CC=CC=C3)C4=NC=CN=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN(N=C2)CC3=CC=CC=C3)C4=NC=CN=C4

InChI

InChI=1S/C19H22N6/c1-2-4-17(5-3-1)15-25-16-18(12-22-25)14-23-8-10-24(11-9-23)19-13-20-6-7-21-19/h1-7,12-13,16H,8-11,14-15H2/p+1