butyl (2S,5R,6R)-6-azanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: butyl (2S,5R,6R)-6-azanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: butyl (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid butyl ester IUPAC Name: butyl (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: (2S,5R,6R)-6-amino-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid butyl ester Formula: C12H20N2O3S MolecularWeight: 272.3638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1C(SC2N1C(=O)C2N)(C)C

Isomeric SMILES

CCCCOC(=O)[C@H]1C(S[C@H]2N1C(=O)[C@H]2N)(C)C

InChI

InChI=1S/C12H20N2O3S/c1-4-5-6-17-11(16)8-12(2,3)18-10-7(13)9(15)14(8)10/h7-8,10H,4-6,13H2,1-3H3/t7-,8+,10-/m1/s1