2-(pyridin-3-ylmethylidene)-4H-[1,3]thiazolo[3,2-a]benzimidazol-9-ium-1-one

Systemtic Name: 2-(pyridin-3-ylmethylidene)-4H-[1,3]thiazolo[3,2-a]benzimidazol-9-ium-1-one Openeye Name: 2-(3-pyridylmethylene)-4H-thiazolo[3,2-a]benzimidazol-9-ium-1-one CAS Name: 2-(3-pyridinylmethylidene)-4H-thiazolo[3,2-a]benzimidazol-9-ium-1-one IUPAC Name: 2-(pyridin-3-ylmethylidene)-4H-[1,3]thiazolo[3,2-a]benzimidazol-9-ium-1-one Traditional Name: 2-(3-pyridylmethylene)-4H-thiazolo[3,2-a]benzimidazol-9-ium-1-one Formula: C15H10N3OS+ MolecularWeight: 280.3244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC3=[N+]2C(=O)C(=CC4=CN=CC=C4)S3

Isomeric SMILES

C1=CC=C2C(=C1)NC3=[N+]2C(=O)C(=CC4=CN=CC=C4)S3

InChI

InChI=1S/C15H9N3OS/c19-14-13(8-10-4-3-7-16-9-10)20-15-17-11-5-1-2-6-12(11)18(14)15/h1-9H/p+1