3-(acetyloxymethyl)-8-oxidanylidene-7-[2-[2-[[2-oxidanylidene-3-(phenylsulfonyl)imidazolidin-1-yl]carbonylamino]phenyl]ethanoylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-(acetyloxymethyl)-8-oxidanylidene-7-[2-[2-[[2-oxidanylidene-3-(phenylsulfonyl)imidazolidin-1-yl]carbonylamino]phenyl]ethanoylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-(acetoxymethyl)-7-[[2-[2-[[3-(benzenesulfonyl)-2-oxo-imidazolidine-1-carbonyl]amino]phenyl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-(acetyloxymethyl)-7-[[2-[2-[[[3-(benzenesulfonyl)-2-oxo-1-imidazolidinyl]-oxomethyl]amino]phenyl]-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-(acetyloxymethyl)-7-[[2-[2-[[3-(benzenesulfonyl)-2-oxoimidazolidine-1-carbonyl]amino]phenyl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-(acetoxymethyl)-7-[[2-[2-[(3-besyl-2-keto-imidazolidine-1-carbonyl)amino]phenyl]acetyl]amino]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C28H27N5O10S2 MolecularWeight: 657.67148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3NC(=O)N4CCN(C4=O)S(=O)(=O)C5=CC=CC=C5)SC1)C(=O)O

Isomeric SMILES

CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3NC(=O)N4CCN(C4=O)S(=O)(=O)C5=CC=CC=C5)SC1)C(=O)O

InChI

InChI=1S/C28H27N5O10S2/c1-16(34)43-14-18-15-44-25-22(24(36)33(25)23(18)26(37)38)30-21(35)13-17-7-5-6-10-20(17)29-27(39)31-11-12-32(28(31)40)45(41,42)19-8-3-2-4-9-19/h2-10,22,25H,11-15H2,1H3,(H,29,39)(H,30,35)(H,37,38)