6-(1-hydroxyethyl)-7-oxidanylidene-3-pyrazolidin-4-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-(1-hydroxyethyl)-7-oxidanylidene-3-pyrazolidin-4-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-(1-hydroxyethyl)-7-oxo-3-pyrazolidin-4-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-(1-hydroxyethyl)-7-oxo-3-(4-pyrazolidinylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-(1-hydroxyethyl)-7-oxo-3-pyrazolidin-4-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-(1-hydroxyethyl)-7-keto-3-(pyrazolidin-4-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)O)SC3CNNC3)O

Isomeric SMILES

CC(C1C2CC(=C(N2C1=O)C(=O)O)SC3CNNC3)O

InChI

InChI=1S/C12H17N3O4S/c1-5(16)9-7-2-8(20-6-3-13-14-4-6)10(12(18)19)15(7)11(9)17/h5-7,9,13-14,16H,2-4H2,1H3,(H,18,19)