1-(5-chloranylpyridin-2-yl)carbonyl-4,5,6,7-tetrahydrobenzimidazole-2-thiolate

Systemtic Name: 1-(5-chloranylpyridin-2-yl)carbonyl-4,5,6,7-tetrahydrobenzimidazole-2-thiolate Openeye Name: 1-(5-chloropyridine-2-carbonyl)-4,5,6,7-tetrahydrobenzimidazole-2-thiolate CAS Name: 1-[(5-chloro-2-pyridinyl)-oxomethyl]-4,5,6,7-tetrahydrobenzimidazole-2-thiolate IUPAC Name: 1-(5-chloropyridine-2-carbonyl)-4,5,6,7-tetrahydrobenzimidazole-2-thiolate Traditional Name: 1-(5-chloropicolinoyl)-4,5,6,7-tetrahydrobenzimidazole-2-thiolate Formula: C13H11ClN3OS- MolecularWeight: 292.76394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(N2C(=O)C3=NC=C(C=C3)Cl)[S-]

Isomeric SMILES

C1CCC2=C(C1)N=C(N2C(=O)C3=NC=C(C=C3)Cl)[S-]

InChI

InChI=1S/C13H12ClN3OS/c14-8-5-6-10(15-7-8)12(18)17-11-4-2-1-3-9(11)16-13(17)19/h5-7H,1-4H2,(H,16,19)/p-1