7-azanyl-3-ethylsulfanylcarbonyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-ethylsulfanylcarbonyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-ethylsulfanylcarbonyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-[(ethylthio)-oxomethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-ethylsulfanylcarbonyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-3-(ethylthio)carbonyl-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C10H12N2O4S2 MolecularWeight: 288.34328

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C1=C(N2C(C(C2=O)N)SC1)C(=O)O

Isomeric SMILES

CCSC(=O)C1=C(N2C(C(C2=O)N)SC1)C(=O)O

InChI

InChI=1S/C10H12N2O4S2/c1-2-17-10(16)4-3-18-8-5(11)7(13)12(8)6(4)9(14)15/h5,8H,2-3,11H2,1H3,(H,14,15)