7-oxidanylidene-6-[5-(phenylsulfanylmethyl)pyrrolidin-3-yl]sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 7-oxidanylidene-6-[5-(phenylsulfanylmethyl)pyrrolidin-3-yl]sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 7-oxo-6-[5-(phenylsulfanylmethyl)pyrrolidin-3-yl]sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 7-oxo-6-[[5-[(phenylthio)methyl]-3-pyrrolidinyl]thio]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 7-oxo-6-[5-(phenylsulfanylmethyl)pyrrolidin-3-yl]sulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 7-keto-6-[[5-[(phenylthio)methyl]pyrrolidin-3-yl]thio]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C18H19N2O3S2- MolecularWeight: 375.48506

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N2C1C(C2=O)SC3CC(NC3)CSC4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

C1C=C(N2C1C(C2=O)SC3CC(NC3)CSC4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C18H20N2O3S2/c21-17-16(14-6-7-15(18(22)23)20(14)17)25-13-8-11(19-9-13)10-24-12-4-2-1-3-5-12/h1-5,7,11,13-14,16,19H,6,8-10H2,(H,22,23)/p-1