4-bromanyl-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]benzamide

Systemtic Name: 4-bromanyl-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]benzamide Openeye Name: 4-bromo-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]benzamide CAS Name: 4-bromo-N-[5-methyl-2-(1-methyl-2-benzimidazolyl)-1H-pyrazol-2-ium-3-yl]benzamide IUPAC Name: 4-bromo-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]benzamide Traditional Name: 4-bromo-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]benzamide Formula: C19H17BrN5O+ MolecularWeight: 411.27518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](N1)C2=NC3=CC=CC=C3N2C)NC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=[N+](N1)C2=NC3=CC=CC=C3N2C)NC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H16BrN5O/c1-12-11-17(22-18(26)13-7-9-14(20)10-8-13)25(23-12)19-21-15-5-3-4-6-16(15)24(19)2/h3-11H,1-2H3,(H,22,23,26)/p+1