3-ethyl-6-(1-hydroxyethyl)-7-sulfanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-ethyl-6-(1-hydroxyethyl)-7-sulfanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-ethyl-6-(1-hydroxyethyl)-7-thioxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-ethyl-6-(1-hydroxyethyl)-7-sulfanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-ethyl-6-(1-hydroxyethyl)-7-sulfanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-ethyl-6-(1-hydroxyethyl)-7-thioxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C10H13NO3S2 MolecularWeight: 259.34512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C(S1)C(C2=S)C(C)O)C(=O)O

Isomeric SMILES

CCC1=C(N2C(S1)C(C2=S)C(C)O)C(=O)O

InChI

InChI=1S/C10H13NO3S2/c1-3-5-7(10(13)14)11-8(15)6(4(2)12)9(11)16-5/h4,6,9,12H,3H2,1-2H3,(H,13,14)