(6S,7R)-7-azanyl-8-oxidanylidene-3-(1,2,3-thiadiazol-4-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: (6S,7R)-7-azanyl-8-oxidanylidene-3-(1,2,3-thiadiazol-4-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: (6S,7R)-7-amino-8-oxo-3-(thiadiazol-4-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: (6S,7R)-7-amino-8-oxo-3-(4-thiadiazolylmethylthio)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: (6S,7R)-7-amino-8-oxo-3-(thiadiazol-4-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: (6S,7R)-7-amino-8-keto-3-(thiadiazol-4-ylmethylthio)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C10H10N4O3S3 MolecularWeight: 330.4064

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)SCC3=CSN=N3

Isomeric SMILES

C1C(=C(N2[C@@H](S1)[C@@H](C2=O)N)C(=O)O)SCC3=CSN=N3

InChI

InChI=1S/C10H10N4O3S3/c11-6-8(15)14-7(10(16)17)5(3-19-9(6)14)18-1-4-2-20-13-12-4/h2,6,9H,1,3,11H2,(H,16,17)/t6-,9+/m1/s1