7-oxidanylidene-6-propan-2-yl-3-pyridin-4-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 7-oxidanylidene-6-propan-2-yl-3-pyridin-4-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-isopropyl-7-oxo-3-(4-pyridylsulfanyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 7-oxo-6-propan-2-yl-3-(pyridin-4-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 7-oxo-6-propan-2-yl-3-pyridin-4-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-isopropyl-7-keto-3-(4-pyridylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2CC(=C(N2C1=O)C(=O)O)SC3=CC=NC=C3

Isomeric SMILES

CC(C)C1C2CC(=C(N2C1=O)C(=O)O)SC3=CC=NC=C3

InChI

InChI=1S/C15H16N2O3S/c1-8(2)12-10-7-11(21-9-3-5-16-6-4-9)13(15(19)20)17(10)14(12)18/h3-6,8,10,12H,7H2,1-2H3,(H,19,20)