3-[(2-azanyl-1,3-thiazol-5-yl)sulfanylmethyl]-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-[(2-azanyl-1,3-thiazol-5-yl)sulfanylmethyl]-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-[(2-aminothiazol-5-yl)sulfanylmethyl]-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-[[(2-amino-5-thiazolyl)thio]methyl]-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-[(2-amino-1,3-thiazol-5-yl)sulfanylmethyl]-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-[[(2-aminothiazol-5-yl)thio]methyl]-6-(1-hydroxyethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C12H13N3O4S3 MolecularWeight: 359.44432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)CSC3=CN=C(S3)N)C(=O)O)O

Isomeric SMILES

CC(C1C2N(C1=O)C(=C(S2)CSC3=CN=C(S3)N)C(=O)O)O

InChI

InChI=1S/C12H13N3O4S3/c1-4(16)7-9(17)15-8(11(18)19)5(21-10(7)15)3-20-6-2-14-12(13)22-6/h2,4,7,10,16H,3H2,1H3,(H2,13,14)(H,18,19)