S-(1H-benzimidazol-2-yl) pyridine-3-carbothioate

Systemtic Name: S-(1H-benzimidazol-2-yl) pyridine-3-carbothioate Openeye Name: S-(1H-benzimidazol-2-yl) pyridine-3-carbothioate CAS Name: 3-pyridinecarbothioic acid S-(1H-benzimidazol-2-yl) ester IUPAC Name: S-(1H-benzimidazol-2-yl) pyridine-3-carbothioate Traditional Name: pyridine-3-carbothioic acid S-(1H-benzimidazol-2-yl) ester Formula: C13H9N3OS MolecularWeight: 255.29506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SC(=O)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SC(=O)C3=CN=CC=C3

InChI

InChI=1S/C13H9N3OS/c17-12(9-4-3-7-14-8-9)18-13-15-10-5-1-2-6-11(10)16-13/h1-8H,(H,15,16)