2-[(3-cyano-2-sulfanyl-propanoyl)amino]-7-oxidanylidene-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 2-[(3-cyano-2-sulfanyl-propanoyl)amino]-7-oxidanylidene-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 2-[(3-cyano-2-sulfanyl-propanoyl)amino]-7-oxo-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 2-[(3-cyano-2-mercapto-1-oxopropyl)amino]-7-oxo-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 2-[(3-cyano-2-sulfanylpropanoyl)amino]-7-oxo-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 2-[(3-cyano-2-mercapto-propanoyl)amino]-7-keto-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C10H11N3O4S2 MolecularWeight: 301.34204

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CSC(N2C1=O)(C(=O)O)NC(=O)C(CC#N)S

Isomeric SMILES

C1C2CSC(N2C1=O)(C(=O)O)NC(=O)C(CC#N)S

InChI

InChI=1S/C10H11N3O4S2/c11-2-1-6(18)8(15)12-10(9(16)17)13-5(4-19-10)3-7(13)14/h5-6,18H,1,3-4H2,(H,12,15)(H,16,17)