6-cyclopropyl-7-oxidanylidene-3-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-cyclopropyl-7-oxidanylidene-3-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-cyclopropyl-7-oxo-3-(3-oxo-3-pyrrolidin-1-yl-propyl)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-cyclopropyl-7-oxo-3-[3-oxo-3-(1-pyrrolidinyl)propyl]-6-(3-pyrrolidinylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-cyclopropyl-7-oxo-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-cyclopropyl-7-keto-3-(3-keto-3-pyrrolidino-propyl)-6-(pyrrolidin-3-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC2=C(N3C(C2)C(C3=O)(C4CC4)SC5CCNC5)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)CCC2=C(N3C(C2)C(C3=O)(C4CC4)SC5CCNC5)C(=O)O

InChI

InChI=1S/C21H29N3O4S/c25-17(23-9-1-2-10-23)6-3-13-11-16-21(14-4-5-14,29-15-7-8-22-12-15)20(28)24(16)18(13)19(26)27/h14-16,22H,1-12H2,(H,26,27)