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

Systemtic Name: 6-(2-hydroxyethyl)-3-(3-methyl-7-methylsulfanyl-imidazo[5,1-b][1,3]thiazol-2-yl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 6-(2-hydroxyethyl)-3-(3-methyl-7-methylsulfanyl-imidazo[5,1-b]thiazol-2-yl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(2-hydroxyethyl)-3-[3-methyl-7-(methylthio)-2-imidazo[5,1-b]thiazolyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 6-(2-hydroxyethyl)-3-(3-methyl-7-methylsulfanylimidazo[5,1-b][1,3]thiazol-2-yl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(2-hydroxyethyl)-7-keto-3-[3-methyl-7-(methylthio)imidazo[5,1-b]thiazol-2-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C16H16N3O4S2- MolecularWeight: 378.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C(N=CN12)SC)C3=C(N4C(C3)C(C4=O)CCO)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C(N=CN12)SC)C3=C(N4C(C3)C(C4=O)CCO)C(=O)[O-]

InChI

InChI=1S/C16H17N3O4S2/c1-7-12(25-15-13(24-2)17-6-18(7)15)9-5-10-8(3-4-20)14(21)19(10)11(9)16(22)23/h6,8,10,20H,3-5H2,1-2H3,(H,22,23)/p-1