(diphenylmethyl) (2S,5R)-6-(3,3-dimethylbut-1-enylidene)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (diphenylmethyl) (2S,5R)-6-(3,3-dimethylbut-1-enylidene)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzhydryl (2S,5R)-6-(3,3-dimethylbut-1-enylidene)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: (2S,5R)-6-(3,3-dimethylbut-1-enylidene)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (2S,5R)-6-(3,3-dimethylbut-1-enylidene)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: (2S,5R)-6-(3,3-dimethylbut-1-enylidene)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzhydryl ester Formula: C27H29NO3S MolecularWeight: 447.58906

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(=C=CC(C)(C)C)C2=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1([C@@H](N2[C@H](S1)C(=C=CC(C)(C)C)C2=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C27H29NO3S/c1-26(2,3)17-16-20-23(29)28-22(27(4,5)32-24(20)28)25(30)31-21(18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17,21-22,24H,1-5H3/t16?,22-,24+/m0/s1