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

Systemtic Name: 7-oxidanylidene-6-[3-(pyrrolidin-2-ylcarbonylamino)azetidin-1-yl]carbonyl-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 7-oxo-6-[3-(pyrrolidine-2-carbonylamino)azetidine-1-carbonyl]-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 7-oxo-6-[oxo-[3-[[oxo(2-pyrrolidinyl)methyl]amino]-1-azetidinyl]methyl]-6-(3-pyrrolidinylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 7-oxo-6-[3-(pyrrolidine-2-carbonylamino)azetidine-1-carbonyl]-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 7-keto-6-[3-(prolylamino)azetidine-1-carbonyl]-6-(pyrrolidin-3-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C20H27N5O5S MolecularWeight: 449.52388

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NC2CN(C2)C(=O)C3(C4CC=C(N4C3=O)C(=O)O)SC5CCNC5

Isomeric SMILES

C1CC(NC1)C(=O)NC2CN(C2)C(=O)C3(C4CC=C(N4C3=O)C(=O)O)SC5CCNC5

InChI

InChI=1S/C20H27N5O5S/c26-16(13-2-1-6-22-13)23-11-9-24(10-11)18(29)20(31-12-5-7-21-8-12)15-4-3-14(17(27)28)25(15)19(20)30/h3,11-13,15,21-22H,1-2,4-10H2,(H,23,26)(H,27,28)