8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 8-oxo-7-[[2-(2-thienyl)acetyl]amino]-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-[[2-(2-thienyl)acetyl]amino]-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H12N2O4S2 MolecularWeight: 324.37538

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C(=O)N2C(=CS1)C(=O)O)NC(=O)CC3=CC=CS3

Isomeric SMILES

C1C2C(C(=O)N2C(=CS1)C(=O)O)NC(=O)CC3=CC=CS3

InChI

InChI=1S/C13H12N2O4S2/c16-10(4-7-2-1-3-21-7)14-11-8-5-20-6-9(13(18)19)15(8)12(11)17/h1-3,6,8,11H,4-5H2,(H,14,16)(H,18,19)