(diphenylmethyl) 7-[[(2Z)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]imino-2-naphthalen-2-yl-ethanoyl]amino]-3-methylsulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 7-[[(2Z)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]imino-2-naphthalen-2-yl-ethanoyl]amino]-3-methylsulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 7-[[(2Z)-2-(2-tert-butoxy-2-oxo-ethoxy)imino-2-(2-naphthyl)acetyl]amino]-3-methylsulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[[(2Z)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]imino-2-(2-naphthalenyl)-1-oxoethyl]amino]-3-(methylthio)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-[[(2Z)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]imino-2-naphthalen-2-ylacetyl]amino]-3-methylsulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[[(2Z)-2-(2-tert-butoxy-2-keto-ethyl)oximino-2-(2-naphthyl)acetyl]amino]-8-keto-3-(methylthio)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C39H37N3O7S2 MolecularWeight: 723.85698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CON=C(C1=CC2=CC=CC=C2C=C1)C(=O)NC3C4N(C3=O)C(=C(CS4)SC)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C)OC(=O)CO/N=C(/C1=CC2=CC=CC=C2C=C1)\C(=O)NC3C4N(C3=O)C(=C(CS4)SC)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C39H37N3O7S2/c1-39(2,3)49-30(43)22-47-41-31(28-20-19-24-13-11-12-18-27(24)21-28)35(44)40-32-36(45)42-33(29(50-4)23-51-37(32)42)38(46)48-34(25-14-7-5-8-15-25)26-16-9-6-10-17-26/h5-21,32,34,37H,22-23H2,1-4H3,(H,40,44)/b41-31-