S-[3-(2-bromanylethanoylamino)-1-[(Z)-4-bromanyl-1-(2-methylpentan-2-yloxy)-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-4-oxidanylidene-azetidin-2-yl] methanethioate

Systemtic Name: S-[3-(2-bromanylethanoylamino)-1-[(Z)-4-bromanyl-1-(2-methylpentan-2-yloxy)-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-4-oxidanylidene-azetidin-2-yl] methanethioate Openeye Name: S-[3-[(2-bromoacetyl)amino]-1-[(1Z)-3-bromo-1-[1,1-dimethylbutoxy(hydroxy)methylene]-2-oxo-propyl]-4-oxo-azetidin-2-yl] methanethioate CAS Name: methanethioic acid S-[1-[(Z)-4-bromo-1-hydroxy-1-(2-methylpentan-2-yloxy)-3-oxobut-1-en-2-yl]-3-[(2-bromo-1-oxoethyl)amino]-4-oxo-2-azetidinyl] ester IUPAC Name: S-[3-[(2-bromoacetyl)amino]-1-[(Z)-4-bromo-1-hydroxy-1-(2-methylpentan-2-yloxy)-3-oxobut-1-en-2-yl]-4-oxoazetidin-2-yl] methanethioate Traditional Name: methanethioic acid S-[3-[(2-bromoacetyl)amino]-1-[(Z)-1-(2-bromoacetyl)-2-(1,1-dimethylbutoxy)-2-hydroxy-vinyl]-4-keto-azetidin-2-yl] ester Formula: C16H22Br2N2O6S MolecularWeight: 530.22868

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)OC(=C(C(=O)CBr)N1C(C(C1=O)NC(=O)CBr)SC=O)O

Isomeric SMILES

CCCC(C)(C)O/C(=C(/C(=O)CBr)\N1C(C(C1=O)NC(=O)CBr)SC=O)/O

InChI

InChI=1S/C16H22Br2N2O6S/c1-4-5-16(2,3)26-15(25)12(9(22)6-17)20-13(24)11(14(20)27-8-21)19-10(23)7-18/h8,11,14,25H,4-7H2,1-3H3,(H,19,23)/b15-12-