3-methyl-1H-benzimidazol-3-ium-2-carbothialdehyde

Systemtic Name: 3-methyl-1H-benzimidazol-3-ium-2-carbothialdehyde Openeye Name: 3-methyl-1H-benzimidazol-3-ium-2-carbothialdehyde CAS Name: 3-methyl-1H-benzimidazol-3-ium-2-carbothioaldehyde IUPAC Name: 3-methyl-1H-benzimidazol-3-ium-2-carbothialdehyde Traditional Name: 3-methyl-1H-benzimidazol-3-ium-2-carbothialdehyde Formula: C9H9N2S+ MolecularWeight: 177.24616

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)C=S

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)C=S

InChI

InChI=1S/C9H8N2S/c1-11-8-5-3-2-4-7(8)10-9(11)6-12/h2-6H,1H3/p+1