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

Systemtic Name: 3-bromanyl-N-[2-(1-ethylbenzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]benzamide Openeye Name: 3-bromo-N-[2-(1-ethylbenzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]benzamide CAS Name: 3-bromo-N-[2-(1-ethyl-2-benzimidazolyl)-5-methyl-1H-pyrazol-2-ium-3-yl]benzamide IUPAC Name: 3-bromo-N-[2-(1-ethylbenzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]benzamide Traditional Name: 3-bromo-N-[2-(1-ethylbenzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]benzamide Formula: C20H19BrN5O+ MolecularWeight: 425.30176

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1[N+]3=C(C=C(N3)C)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1[N+]3=C(C=C(N3)C)NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H18BrN5O/c1-3-25-17-10-5-4-9-16(17)22-20(25)26-18(11-13(2)24-26)23-19(27)14-7-6-8-15(21)12-14/h4-12H,3H2,1-2H3,(H,23,24,27)/p+1