8-oxidanylidene-3-(oxolan-2-ylideneamino)-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 8-oxidanylidene-3-(oxolan-2-ylideneamino)-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 8-oxo-3-(tetrahydrofuran-2-ylideneamino)-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 8-oxo-3-(2-oxolanylideneamino)-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 8-oxo-3-(oxolan-2-ylideneamino)-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-3-(tetrahydrofurylideneamino)-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C17H17N3O5S2 MolecularWeight: 407.46398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NC2=C(N3C(C(C3=O)NC(=O)CC4=CC=CS4)SC2)C(=O)O)OC1

Isomeric SMILES

C1CC(=NC2=C(N3C(C(C3=O)NC(=O)CC4=CC=CS4)SC2)C(=O)O)OC1

InChI

InChI=1S/C17H17N3O5S2/c21-11(7-9-3-2-6-26-9)19-13-15(22)20-14(17(23)24)10(8-27-16(13)20)18-12-4-1-5-25-12/h2-3,6,13,16H,1,4-5,7-8H2,(H,19,21)(H,23,24)