5-methyl-3-phenyl-2-sulfanylidene-[1,2,4]triazino[1,6-a]benzimidazol-10-ium-4-olate

Systemtic Name: 5-methyl-3-phenyl-2-sulfanylidene-[1,2,4]triazino[1,6-a]benzimidazol-10-ium-4-olate Openeye Name: 5-methyl-3-phenyl-2-thioxo-[1,2,4]triazino[1,6-a]benzimidazol-10-ium-4-olate CAS Name: 5-methyl-3-phenyl-2-sulfanylidene-[1,2,4]triazino[1,6-a]benzimidazol-10-ium-4-olate IUPAC Name: 5-methyl-3-phenyl-2-sulfanylidene-[1,2,4]triazino[1,6-a]benzimidazol-10-ium-4-olate Traditional Name: 5-methyl-3-phenyl-2-thioxo-[1,2,4]triazino[1,6-a]benzimidazol-10-ium-4-olate Formula: C16H12N4OS MolecularWeight: 308.35768

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2[N+]3=NC(=S)N(C(=C13)[O-])C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2[N+]3=NC(=S)N(C(=C13)[O-])C4=CC=CC=C4

InChI

InChI=1S/C16H12N4OS/c1-18-12-9-5-6-10-13(12)20-14(18)15(21)19(16(22)17-20)11-7-3-2-4-8-11/h2-10H,1H3