(diphenylmethyl) (7E)-3-cyano-5,5,8-tris(oxidanylidene)-7-(pyridin-2-ylmethylidene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) (7E)-3-cyano-5,5,8-tris(oxidanylidene)-7-(pyridin-2-ylmethylidene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl (7E)-3-cyano-5,5,8-trioxo-7-(2-pyridylmethylene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (7E)-3-cyano-5,5,8-trioxo-7-(2-pyridinylmethylidene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (7E)-3-cyano-5,5,8-trioxo-7-(pyridin-2-ylmethylidene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (7E)-3-cyano-5,5,8-triketo-7-(2-pyridylmethylene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C27H19N3O5S MolecularWeight: 497.52186

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1(=O)=O)C(=CC3=CC=CC=N3)C2=O)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1C(=C(N2C(S1(=O)=O)/C(=C/C3=CC=CC=N3)/C2=O)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C27H19N3O5S/c28-16-20-17-36(33,34)26-22(15-21-13-7-8-14-29-21)25(31)30(26)23(20)27(32)35-24(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-15,24,26H,17H2/b22-15+