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

Systemtic Name: 1-[[4-(1H-pyrazol-5-yl)thiophen-2-yl]methyl]piperazin-4-ium Openeye Name: 1-[[4-(1H-pyrazol-5-yl)-2-thienyl]methyl]piperazin-4-ium CAS Name: 1-[[4-(1H-pyrazol-5-yl)-2-thiophenyl]methyl]piperazin-4-ium IUPAC Name: 1-[[4-(1H-pyrazol-5-yl)thiophen-2-yl]methyl]piperazin-4-ium Traditional Name: 1-[[4-(1H-pyrazol-5-yl)-2-thienyl]methyl]piperazin-4-ium Formula: C12H17N4S+ MolecularWeight: 249.35518

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=CC(=CS2)C3=CC=NN3

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=CC(=CS2)C3=CC=NN3

InChI

InChI=1S/C12H16N4S/c1-2-14-15-12(1)10-7-11(17-9-10)8-16-5-3-13-4-6-16/h1-2,7,9,13H,3-6,8H2,(H,14,15)/p+1