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

Systemtic Name: 6-(1-hydroxyethyl)-7-oxidanylidene-3-(5-pyrrolidin-3-ylpyrrolidin-3-yl)sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-(1-hydroxyethyl)-7-oxo-3-(5-pyrrolidin-3-ylpyrrolidin-3-yl)sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-(1-hydroxyethyl)-7-oxo-3-[[5-(3-pyrrolidinyl)-3-pyrrolidinyl]thio]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-(1-hydroxyethyl)-7-oxo-3-(5-pyrrolidin-3-ylpyrrolidin-3-yl)sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-(1-hydroxyethyl)-7-keto-3-[(5-pyrrolidin-3-ylpyrrolidin-3-yl)thio]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)O)SC3CC(NC3)C4CCNC4)O

Isomeric SMILES

CC(C1C2CC(=C(N2C1=O)C(=O)O)SC3CC(NC3)C4CCNC4)O

InChI

InChI=1S/C17H25N3O4S/c1-8(21)14-12-5-13(15(17(23)24)20(12)16(14)22)25-10-4-11(19-7-10)9-2-3-18-6-9/h8-12,14,18-19,21H,2-7H2,1H3,(H,23,24)