3-azanyl-2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-4-thiol

Systemtic Name: 3-azanyl-2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-4-thiol Openeye Name: 3-amino-2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-4-thiol CAS Name: 3-amino-2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-4-thiol IUPAC Name: 3-amino-2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-4-thiol Traditional Name: 3-amino-2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-4-thiol Formula: C11H12N5S+ MolecularWeight: 246.31148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](N1)C2=NC3=CC=CC=C3N2)N)S

Isomeric SMILES

CC1=C(C(=[N+](N1)C2=NC3=CC=CC=C3N2)N)S

InChI

InChI=1S/C11H11N5S/c1-6-9(17)10(12)16(15-6)11-13-7-4-2-3-5-8(7)14-11/h2-5H,1H3,(H4,12,13,14,15,17)/p+1