2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-3-(2-phenoxyethanoyloxy)azetidin-1-yl]-3-methyl-but-2-enoic acid

Systemtic Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-3-(2-phenoxyethanoyloxy)azetidin-1-yl]-3-methyl-but-2-enoic acid Openeye Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-(2-phenoxyacetyl)oxy-azetidin-1-yl]-3-methyl-but-2-enoic acid CAS Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-(1-oxo-2-phenoxyethoxy)-1-azetidinyl]-3-methyl-2-butenoic acid IUPAC Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-(2-phenoxyacetyl)oxyazetidin-1-yl]-3-methylbut-2-enoic acid Traditional Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-keto-3-(2-phenoxyacetyl)oxy-azetidin-1-yl]-3-methyl-but-2-enoic acid Formula: C23H20N2O6S3 MolecularWeight: 516.6097

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)O)N1C(C(C1=O)OC(=O)COC2=CC=CC=C2)SSC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC(=C(C(=O)O)N1C(C(C1=O)OC(=O)COC2=CC=CC=C2)SSC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C23H20N2O6S3/c1-13(2)18(22(28)29)25-20(27)19(31-17(26)12-30-14-8-4-3-5-9-14)21(25)33-34-23-24-15-10-6-7-11-16(15)32-23/h3-11,19,21H,12H2,1-2H3,(H,28,29)