7-azanyl-3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-(2-amino-2-oxo-ethyl)sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-[(2-amino-2-oxoethyl)thio]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-(2-amino-2-oxoethyl)sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-3-[(2-amino-2-keto-ethyl)thio]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C9H11N3O4S2 MolecularWeight: 289.33134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)SCC(=O)N

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)SCC(=O)N

InChI

InChI=1S/C9H11N3O4S2/c10-4(13)2-17-3-1-18-8-5(11)7(14)12(8)6(3)9(15)16/h5,8H,1-2,11H2,(H2,10,13)(H,15,16)