7-oxidanylidene-3-(1,2,3-triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 7-oxidanylidene-3-(1,2,3-triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 7-oxo-3-(triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 7-oxo-3-(1-triazolylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 7-oxo-3-(triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 7-keto-3-(triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C9H10N4O3S MolecularWeight: 254.2657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(C(S2)CN3C=CN=N3)C(=O)O

Isomeric SMILES

C1C2N(C1=O)C(C(S2)CN3C=CN=N3)C(=O)O

InChI

InChI=1S/C9H10N4O3S/c14-6-3-7-13(6)8(9(15)16)5(17-7)4-12-2-1-10-11-12/h1-2,5,7-8H,3-4H2,(H,15,16)