(diphenylmethyl) 8-oxidanylidene-3-[[4-[2-oxidanylidene-2-(pyridin-2-ylmethylamino)ethyl]-1,3-thiazol-2-yl]sulfanyl]-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 8-oxidanylidene-3-[[4-[2-oxidanylidene-2-(pyridin-2-ylmethylamino)ethyl]-1,3-thiazol-2-yl]sulfanyl]-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 8-oxo-3-[4-[2-oxo-2-(2-pyridylmethylamino)ethyl]thiazol-2-yl]sulfanyl-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-7-[(1-oxo-2-phenylethyl)amino]-3-[[4-[2-oxo-2-(2-pyridinylmethylamino)ethyl]-2-thiazolyl]thio]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 8-oxo-3-[[4-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]-1,3-thiazol-2-yl]sulfanyl]-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-3-[[4-[2-keto-2-(2-pyridylmethylamino)ethyl]thiazol-2-yl]thio]-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C39H33N5O5S3 MolecularWeight: 747.90482

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)SC6=NC(=CS6)CC(=O)NCC7=CC=CC=N7

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)SC6=NC(=CS6)CC(=O)NCC7=CC=CC=N7

InChI

InChI=1S/C39H33N5O5S3/c45-31(41-22-28-18-10-11-19-40-28)21-29-23-51-39(42-29)52-30-24-50-37-33(43-32(46)20-25-12-4-1-5-13-25)36(47)44(37)34(30)38(48)49-35(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-19,23,33,35,37H,20-22,24H2,(H,41,45)(H,43,46)