[5-[(2-propan-2-yl-1H-imidazol-3-ium-3-yl)methyl]-1H-pyrazol-3-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [5-[(2-propan-2-yl-1H-imidazol-3-ium-3-yl)methyl]-1H-pyrazol-3-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: [5-[(2-isopropyl-1H-imidazol-3-ium-3-yl)methyl]-1H-pyrazol-3-yl]-[4-(3-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [5-[(2-propan-2-yl-1H-imidazol-3-ium-3-yl)methyl]-1H-pyrazol-3-yl]-[4-(3-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: [5-[(2-propan-2-yl-1H-imidazol-3-ium-3-yl)methyl]-1H-pyrazol-3-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: [5-[(2-isopropyl-1H-imidazol-3-ium-3-yl)methyl]-1H-pyrazol-3-yl]-[4-(3-pyridylmethyl)piperazino]methanone Formula: C21H28N7O+ MolecularWeight: 394.49332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C=CN1)CC2=CC(=NN2)C(=O)N3CCN(CC3)CC4=CN=CC=C4

Isomeric SMILES

CC(C)C1=[N+](C=CN1)CC2=CC(=NN2)C(=O)N3CCN(CC3)CC4=CN=CC=C4

InChI

InChI=1S/C21H27N7O/c1-16(2)20-23-6-7-28(20)15-18-12-19(25-24-18)21(29)27-10-8-26(9-11-27)14-17-4-3-5-22-13-17/h3-7,12-13,16H,8-11,14-15H2,1-2H3,(H,24,25,29)/p+1