(diphenylmethyl) (6R,7R)-3-[[ethyl(methyl)carbamoyl]oxymethyl]-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) (6R,7R)-3-[[ethyl(methyl)carbamoyl]oxymethyl]-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl (6R,7R)-3-[[ethyl(methyl)carbamoyl]oxymethyl]-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (6R,7R)-3-[[[ethyl(methyl)amino]-oxomethoxy]methyl]-8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (6R,7R)-3-[[ethyl(methyl)carbamoyl]oxymethyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (6R,7R)-3-[[ethyl(methyl)carbamoyl]oxymethyl]-8-keto-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C31H31N3O6S2 MolecularWeight: 605.72434

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)OCC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CS3)SC1)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCN(C)C(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CC3=CC=CS3)SC1)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H31N3O6S2/c1-3-33(2)31(38)39-18-22-19-42-29-25(32-24(35)17-23-15-10-16-41-23)28(36)34(29)26(22)30(37)40-27(20-11-6-4-7-12-20)21-13-8-5-9-14-21/h4-16,25,27,29H,3,17-19H2,1-2H3,(H,32,35)/t25-,29-/m1/s1