(diphenylmethyl) (5R)-3-(2-hydroxyethylsulfanyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) (5R)-3-(2-hydroxyethylsulfanyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: benzhydryl (5R)-3-(2-hydroxyethylsulfanyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: (5R)-3-(2-hydroxyethylthio)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (5R)-3-(2-hydroxyethylsulfanyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: (5R)-3-(2-hydroxyethylthio)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid benzhydryl ester Formula: C21H19NO4S2 MolecularWeight: 413.50986

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(=C(S2)SCCO)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H]2N(C1=O)C(=C(S2)SCCO)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H19NO4S2/c23-11-12-27-21-18(22-16(24)13-17(22)28-21)20(25)26-19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,17,19,23H,11-13H2/t17-/m1/s1