6-ethyl-7-oxidanylidene-3-pyridin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-ethyl-7-oxidanylidene-3-pyridin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-ethyl-7-oxo-3-(3-pyridylsulfanyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-ethyl-7-oxo-3-(3-pyridinylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-ethyl-7-oxo-3-pyridin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-ethyl-7-keto-3-(3-pyridylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2CC(=C(N2C1=O)C(=O)O)SC3=CN=CC=C3

Isomeric SMILES

CCC1C2CC(=C(N2C1=O)C(=O)O)SC3=CN=CC=C3

InChI

InChI=1S/C14H14N2O3S/c1-2-9-10-6-11(20-8-4-3-5-15-7-8)12(14(18)19)16(10)13(9)17/h3-5,7,9-10H,2,6H2,1H3,(H,18,19)