3-(1-azanylpropan-2-ylsulfanyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-(1-azanylpropan-2-ylsulfanyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-(2-amino-1-methyl-ethyl)sulfanyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-(1-aminopropan-2-ylthio)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-(1-aminopropan-2-ylsulfanyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-[(2-amino-1-methyl-ethyl)thio]-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C9H12N2O3S2 MolecularWeight: 260.33318

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)SC1=C(N2C(S1)CC2=O)C(=O)O

Isomeric SMILES

CC(CN)SC1=C(N2C(S1)CC2=O)C(=O)O

InChI

InChI=1S/C9H12N2O3S2/c1-4(3-10)15-9-7(8(13)14)11-5(12)2-6(11)16-9/h4,6H,2-3,10H2,1H3,(H,13,14)