N-(2-ethylpyrazol-3-yl)-2-[4-(6-piperazin-4-ium-1-ylpyridin-2-yl)pyrazol-1-yl]ethanamide

Systemtic Name: N-(2-ethylpyrazol-3-yl)-2-[4-(6-piperazin-4-ium-1-ylpyridin-2-yl)pyrazol-1-yl]ethanamide Openeye Name: N-(2-ethylpyrazol-3-yl)-2-[4-(6-piperazin-4-ium-1-yl-2-pyridyl)pyrazol-1-yl]acetamide CAS Name: N-(2-ethyl-3-pyrazolyl)-2-[4-[6-(1-piperazin-4-iumyl)-2-pyridinyl]-1-pyrazolyl]acetamide IUPAC Name: N-(2-ethylpyrazol-3-yl)-2-[4-(6-piperazin-4-ium-1-ylpyridin-2-yl)pyrazol-1-yl]acetamide Traditional Name: N-(2-ethylpyrazol-3-yl)-2-[4-(6-piperazin-4-ium-1-yl-2-pyridyl)pyrazol-1-yl]acetamide Formula: C19H25N8O+ MolecularWeight: 381.4548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)NC(=O)CN2C=C(C=N2)C3=NC(=CC=C3)N4CC[NH2+]CC4

Isomeric SMILES

CCN1C(=CC=N1)NC(=O)CN2C=C(C=N2)C3=NC(=CC=C3)N4CC[NH2+]CC4

InChI

InChI=1S/C19H24N8O/c1-2-27-18(6-7-21-27)24-19(28)14-26-13-15(12-22-26)16-4-3-5-17(23-16)25-10-8-20-9-11-25/h3-7,12-13,20H,2,8-11,14H2,1H3,(H,24,28)/p+1