7-oxidanylidene-6-propan-2-yl-3-(1H-pyrrol-3-ylsulfanyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 7-oxidanylidene-6-propan-2-yl-3-(1H-pyrrol-3-ylsulfanyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-isopropyl-7-oxo-3-(1H-pyrrol-3-ylsulfanyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 7-oxo-6-propan-2-yl-3-(1H-pyrrol-3-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 7-oxo-6-propan-2-yl-3-(1H-pyrrol-3-ylsulfanyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-isopropyl-7-keto-3-(1H-pyrrol-3-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3S/c1-7(2)11-9-5-10(20-8-3-4-15-6-8)12(14(18)19)16(9)13(11)17/h3-4,6-7,9,11,15H,5H2,1-2H3,(H,18,19)