N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-chloro-benzothiophene-2-carboxamide Formula: C20H15ClN5OS+ MolecularWeight: 408.884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](N1)C2=NC3=CC=CC=C3N2)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

CC1=CC(=[N+](N1)C2=NC3=CC=CC=C3N2)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C20H14ClN5OS/c1-11-10-16(26(25-11)20-22-13-7-3-4-8-14(13)23-20)24-19(27)18-17(21)12-6-2-5-9-15(12)28-18/h2-10H,1H3,(H2,22,23,24,25,27)/p+1