2-[1-prop-2-enoxycarbonyl-5-[[3-prop-2-enoxycarbonyl-5-(trifluoromethyl)phenyl]carbamoyl]pyrrolidin-3-yl]ethanethioate

Systemtic Name: 2-[1-prop-2-enoxycarbonyl-5-[[3-prop-2-enoxycarbonyl-5-(trifluoromethyl)phenyl]carbamoyl]pyrrolidin-3-yl]ethanethioate Openeye Name: 2-[1-allyloxycarbonyl-5-[[3-allyloxycarbonyl-5-(trifluoromethyl)phenyl]carbamoyl]pyrrolidin-3-yl]ethanethioate CAS Name: 2-[5-[oxo-[3-[oxo(prop-2-enoxy)methyl]-5-(trifluoromethyl)anilino]methyl]-1-[oxo(prop-2-enoxy)methyl]-3-pyrrolidinyl]ethanethioate IUPAC Name: 2-[1-prop-2-enoxycarbonyl-5-[[3-prop-2-enoxycarbonyl-5-(trifluoromethyl)phenyl]carbamoyl]pyrrolidin-3-yl]ethanethioate Traditional Name: 2-[1-allyloxycarbonyl-5-[[3-allyloxycarbonyl-5-(trifluoromethyl)phenyl]carbamoyl]pyrrolidin-3-yl]thioacetate Formula: C22H22F3N2O6S- MolecularWeight: 499.48009

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2CC(CN2C(=O)OCC=C)CC(=S)[O-])C(F)(F)F

Isomeric SMILES

C=CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2CC(CN2C(=O)OCC=C)CC(=S)[O-])C(F)(F)F

InChI

InChI=1S/C22H23F3N2O6S/c1-3-5-32-20(30)14-9-15(22(23,24)25)11-16(10-14)26-19(29)17-7-13(8-18(28)34)12-27(17)21(31)33-6-4-2/h3-4,9-11,13,17H,1-2,5-8,12H2,(H,26,29)(H,28,34)/p-1