[2,3,5,6-tetrakis(fluoranyl)phenyl] 2-[methyl-[5-(2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoyl]amino]ethanoate

Systemtic Name: [2,3,5,6-tetrakis(fluoranyl)phenyl] 2-[methyl-[5-(2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoyl]amino]ethanoate Openeye Name: (2,3,5,6-tetrafluorophenyl) 2-[methyl-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoyl]amino]acetate CAS Name: 2-[methyl-[1-oxo-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentyl]amino]acetic acid (2,3,5,6-tetrafluorophenyl) ester IUPAC Name: (2,3,5,6-tetrafluorophenyl) 2-[methyl-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoyl]amino]acetate Traditional Name: 2-[5-(2-keto-1,3,3a,4,6,6a-hexahydrothien[3,4-d]imidazol-4-yl)pentanoyl-methyl-amino]acetic acid (2,3,5,6-tetrafluorophenyl) ester Formula: C19H21F4N3O4S MolecularWeight: 463.446353

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC1=C(C(=CC(=C1F)F)F)F)C(=O)CCCCC2C3C(CS2)NC(=O)N3

Isomeric SMILES

CN(CC(=O)OC1=C(C(=CC(=C1F)F)F)F)C(=O)CCCCC2C3C(CS2)NC(=O)N3

InChI

InChI=1S/C19H21F4N3O4S/c1-26(7-14(28)30-18-15(22)9(20)6-10(21)16(18)23)13(27)5-3-2-4-12-17-11(8-31-12)24-19(29)25-17/h6,11-12,17H,2-5,7-8H2,1H3,(H2,24,25,29)