6-(1-hydroxyethyl)-7-oxidanylidene-3-(5-pyrrolidin-1-ylcarbonylpyrrolidin-3-yl)sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-(1-hydroxyethyl)-7-oxidanylidene-3-(5-pyrrolidin-1-ylcarbonylpyrrolidin-3-yl)sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-(1-hydroxyethyl)-7-oxo-3-[5-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-(1-hydroxyethyl)-7-oxo-3-[[5-[oxo(1-pyrrolidinyl)methyl]-3-pyrrolidinyl]thio]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-(1-hydroxyethyl)-7-oxo-3-[5-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-(1-hydroxyethyl)-7-keto-3-[[5-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]thio]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)O)SC3CC(NC3)C(=O)N4CCCC4)O

Isomeric SMILES

CC(C1C2CC(=C(N2C1=O)C(=O)O)SC3CC(NC3)C(=O)N4CCCC4)O

InChI

InChI=1S/C18H25N3O5S/c1-9(22)14-12-7-13(15(18(25)26)21(12)17(14)24)27-10-6-11(19-8-10)16(23)20-4-2-3-5-20/h9-12,14,19,22H,2-8H2,1H3,(H,25,26)