1-oxidanyl-2-pyridin-3-yl-4H-2,4,1-benzodiazaborinine-3-thione

Systemtic Name: 1-oxidanyl-2-pyridin-3-yl-4H-2,4,1-benzodiazaborinine-3-thione Openeye Name: 1-hydroxy-2-(3-pyridyl)-4H-2,4,1-benzodiazaborinine-3-thione CAS Name: 1-hydroxy-2-(3-pyridinyl)-4H-2,4,1-benzodiazaborine-3-thione IUPAC Name: 1-hydroxy-2-pyridin-3-yl-4H-2,4,1-benzodiazaborinine-3-thione Traditional Name: 1-hydroxy-2-(3-pyridyl)-4H-2,4,1-benzodiazaborine-3-thione Formula: C12H10BN3OS MolecularWeight: 255.1033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B1(C2=CC=CC=C2NC(=S)N1C3=CN=CC=C3)O

Isomeric SMILES

B1(C2=CC=CC=C2NC(=S)N1C3=CN=CC=C3)O

InChI

InChI=1S/C12H10BN3OS/c17-13-10-5-1-2-6-11(10)15-12(18)16(13)9-4-3-7-14-8-9/h1-8,17H,(H,15,18)