[1-[3,5-bis(trifluoromethyl)phenyl]-5-sulfanylidene-pyrrolidin-3-yl] tert-butyl carbonate

Systemtic Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-sulfanylidene-pyrrolidin-3-yl] tert-butyl carbonate Openeye Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-thioxo-pyrrolidin-3-yl] tert-butyl carbonate CAS Name: carbonic acid [1-[3,5-bis(trifluoromethyl)phenyl]-5-sulfanylidene-3-pyrrolidinyl] tert-butyl ester IUPAC Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-sulfanylidenepyrrolidin-3-yl] tert-butyl carbonate Traditional Name: carbonic acid [1-[3,5-bis(trifluoromethyl)phenyl]-5-thioxo-pyrrolidin-3-yl] tert-butyl ester Formula: C17H17F6NO3S MolecularWeight: 429.377199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1CC(=S)N(C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)OC1CC(=S)N(C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H17F6NO3S/c1-15(2,3)27-14(25)26-12-7-13(28)24(8-12)11-5-9(16(18,19)20)4-10(6-11)17(21,22)23/h4-6,12H,7-8H2,1-3H3