3-(5-chloranyl-7-methylsulfanyl-imidazo[5,1-b][1,3]thiazol-2-yl)-6-(1-hydroxyethyl)-4-methyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 3-(5-chloranyl-7-methylsulfanyl-imidazo[5,1-b][1,3]thiazol-2-yl)-6-(1-hydroxyethyl)-4-methyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3-(5-chloro-7-methylsulfanyl-imidazo[5,1-b]thiazol-2-yl)-6-(1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-[5-chloro-7-(methylthio)-2-imidazo[5,1-b]thiazolyl]-6-(1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 3-(5-chloro-7-methylsulfanylimidazo[5,1-b][1,3]thiazol-2-yl)-6-(1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-[5-chloro-7-(methylthio)imidazo[5,1-b]thiazol-2-yl]-6-(1-hydroxyethyl)-7-keto-4-methyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C16H15ClN3O4S2- MolecularWeight: 412.891

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C(=O)N2C(=C1C3=CN4C(=C(N=C4Cl)SC)S3)C(=O)[O-])C(C)O

Isomeric SMILES

CC1C2C(C(=O)N2C(=C1C3=CN4C(=C(N=C4Cl)SC)S3)C(=O)[O-])C(C)O

InChI

InChI=1S/C16H16ClN3O4S2/c1-5-8(7-4-19-14(26-7)12(25-3)18-16(19)17)11(15(23)24)20-10(5)9(6(2)21)13(20)22/h4-6,9-10,21H,1-3H3,(H,23,24)/p-1