6-azanyl-6-butylsulfanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-azanyl-6-butylsulfanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-amino-6-butylsulfanyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-amino-6-(butylthio)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-amino-6-butylsulfanyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-amino-6-(butylthio)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C12H20N2O3S2 MolecularWeight: 304.4288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1(C2N(C1=O)C(C(S2)(C)C)C(=O)O)N

Isomeric SMILES

CCCCSC1(C2N(C1=O)C(C(S2)(C)C)C(=O)O)N

InChI

InChI=1S/C12H20N2O3S2/c1-4-5-6-18-12(13)9(17)14-7(8(15)16)11(2,3)19-10(12)14/h7,10H,4-6,13H2,1-3H3,(H,15,16)