(3S,4R,5R)-3-bromanyl-4-tert-butylsulfanyl-5-methoxy-pyrrolidin-2-one

Systemtic Name: (3S,4R,5R)-3-bromanyl-4-tert-butylsulfanyl-5-methoxy-pyrrolidin-2-one Openeye Name: (3S,4R,5R)-3-bromo-4-tert-butylsulfanyl-5-methoxy-pyrrolidin-2-one CAS Name: (3S,4R,5R)-3-bromo-4-(tert-butylthio)-5-methoxy-2-pyrrolidinone IUPAC Name: (3S,4R,5R)-3-bromo-4-tert-butylsulfanyl-5-methoxypyrrolidin-2-one Traditional Name: (3S,4R,5R)-3-bromo-4-(tert-butylthio)-5-methoxy-2-pyrrolidone Formula: C9H16BrNO2S MolecularWeight: 282.19784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1C(C(=O)NC1OC)Br

Isomeric SMILES

CC(C)(C)S[C@H]1[C@H](C(=O)N[C@@H]1OC)Br

InChI

InChI=1S/C9H16BrNO2S/c1-9(2,3)14-6-5(10)7(12)11-8(6)13-4/h5-6,8H,1-4H3,(H,11,12)/t5-,6+,8-/m1/s1