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

Systemtic Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-sulfanylidene-pyrrolidin-3-yl] methyl carbonate Openeye Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-thioxo-pyrrolidin-3-yl] methyl carbonate CAS Name: carbonic acid [1-[3,5-bis(trifluoromethyl)phenyl]-5-sulfanylidene-3-pyrrolidinyl] methyl ester IUPAC Name: [1-[3,5-bis(trifluoromethyl)phenyl]-5-sulfanylidenepyrrolidin-3-yl] methyl carbonate Traditional Name: carbonic acid [1-[3,5-bis(trifluoromethyl)phenyl]-5-thioxo-pyrrolidin-3-yl] methyl ester Formula: C14H11F6NO3S MolecularWeight: 387.297459

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11F6NO3S/c1-23-12(22)24-10-5-11(25)21(6-10)9-3-7(13(15,16)17)2-8(4-9)14(18,19)20/h2-4,10H,5-6H2,1H3