2-[6-chloranyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]benzimidazol-1-yl]ethanol

Systemtic Name: 2-[6-chloranyl-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]benzimidazol-1-yl]ethanol Openeye Name: 2-[6-chloro-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]benzimidazol-1-yl]ethanol CAS Name: 2-[6-chloro-2-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-1-benzimidazolyl]ethanol IUPAC Name: 2-[6-chloro-2-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]benzimidazol-1-yl]ethanol Traditional Name: 2-[6-chloro-2-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]benzimidazol-1-yl]ethanol Formula: C18H22ClN6O+ MolecularWeight: 373.85988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC3=C(N2CCO)C=C(C=C3)Cl)C4=NC=CC=N4

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC3=C(N2CCO)C=C(C=C3)Cl)C4=NC=CC=N4

InChI

InChI=1S/C18H21ClN6O/c19-14-2-3-15-16(12-14)25(10-11-26)17(22-15)13-23-6-8-24(9-7-23)18-20-4-1-5-21-18/h1-5,12,26H,6-11,13H2/p+1