(2S)-2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)propanoate

Systemtic Name: (2S)-2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)propanoate Openeye Name: (2S)-2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)propanoate CAS Name: (2S)-2-(1H-imidazo[4,5-b]pyridin-2-ylthio)propanoate IUPAC Name: (2S)-2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)propanoate Traditional Name: (2S)-2-(1H-imidazo[4,5-b]pyridin-2-ylthio)propionate Formula: C9H8N3O2S- MolecularWeight: 222.24372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NC2=C(N1)C=CC=N2

Isomeric SMILES

C[C@@H](C(=O)[O-])SC1=NC2=C(N1)C=CC=N2

InChI

InChI=1S/C9H9N3O2S/c1-5(8(13)14)15-9-11-6-3-2-4-10-7(6)12-9/h2-5H,1H3,(H,13,14)(H,10,11,12)/p-1/t5-/m0/s1