6-(1-hydroxyethyl)-7-oxidanylidene-3-(7-phenylsulfanylimidazo[5,1-b][1,3]thiazol-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 6-(1-hydroxyethyl)-7-oxidanylidene-3-(7-phenylsulfanylimidazo[5,1-b][1,3]thiazol-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 6-(1-hydroxyethyl)-7-oxo-3-(7-phenylsulfanylimidazo[5,1-b]thiazol-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(1-hydroxyethyl)-7-oxo-3-[7-(phenylthio)-2-imidazo[5,1-b]thiazolyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 6-(1-hydroxyethyl)-7-oxo-3-(7-phenylsulfanylimidazo[5,1-b][1,3]thiazol-2-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(1-hydroxyethyl)-7-keto-3-[7-(phenylthio)imidazo[5,1-b]thiazol-2-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C20H16N3O4S2- MolecularWeight: 426.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)[O-])C3=CN4C=NC(=C4S3)SC5=CC=CC=C5)O

Isomeric SMILES

CC(C1C2CC(=C(N2C1=O)C(=O)[O-])C3=CN4C=NC(=C4S3)SC5=CC=CC=C5)O

InChI

InChI=1S/C20H17N3O4S2/c1-10(24)15-13-7-12(16(20(26)27)23(13)18(15)25)14-8-22-9-21-17(19(22)29-14)28-11-5-3-2-4-6-11/h2-6,8-10,13,15,24H,7H2,1H3,(H,26,27)/p-1