6-(1-hydroxyethyl)-4-methyl-3-(7-methylsulfonylimidazo[5,1-b][1,3]thiazol-2-yl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-4-carboxylic acid

Systemtic Name: 6-(1-hydroxyethyl)-4-methyl-3-(7-methylsulfonylimidazo[5,1-b][1,3]thiazol-2-yl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-4-carboxylic acid Openeye Name: 6-(1-hydroxyethyl)-4-methyl-3-(7-methylsulfonylimidazo[5,1-b]thiazol-2-yl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-4-carboxylic acid CAS Name: 6-(1-hydroxyethyl)-4-methyl-3-(7-methylsulfonyl-2-imidazo[5,1-b]thiazolyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-4-carboxylic acid IUPAC Name: 6-(1-hydroxyethyl)-4-methyl-3-(7-methylsulfonylimidazo[5,1-b][1,3]thiazol-2-yl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-4-carboxylic acid Traditional Name: 6-(1-hydroxyethyl)-7-keto-3-(7-mesylimidazo[5,1-b]thiazol-2-yl)-4-methyl-1-azabicyclo[3.2.0]hept-2-ene-4-carboxylic acid Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2C(C(=CN2C1=O)C3=CN4C=NC(=C4S3)S(=O)(=O)C)(C)C(=O)O)O

Isomeric SMILES

CC(C1C2C(C(=CN2C1=O)C3=CN4C=NC(=C4S3)S(=O)(=O)C)(C)C(=O)O)O

InChI

InChI=1S/C16H17N3O6S2/c1-7(20)10-11-16(2,15(22)23)8(4-19(11)13(10)21)9-5-18-6-17-12(14(18)26-9)27(3,24)25/h4-7,10-11,20H,1-3H3,(H,22,23)