5-fluoranyl-4-oxidanylidene-3-[[2-(phenylmethoxycarbonylamino)-2-thiophen-2-yl-ethanoyl]amino]pentanoic acid

Systemtic Name: 5-fluoranyl-4-oxidanylidene-3-[[2-(phenylmethoxycarbonylamino)-2-thiophen-2-yl-ethanoyl]amino]pentanoic acid Openeye Name: 3-[[2-(benzyloxycarbonylamino)-2-(2-thienyl)acetyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 5-fluoro-4-oxo-3-[[1-oxo-2-(phenylmethoxycarbonylamino)-2-thiophen-2-ylethyl]amino]pentanoic acid IUPAC Name: 5-fluoro-4-oxo-3-[[2-(phenylmethoxycarbonylamino)-2-thiophen-2-ylacetyl]amino]pentanoic acid Traditional Name: 3-[[2-(benzyloxycarbonylamino)-2-(2-thienyl)acetyl]amino]-5-fluoro-4-keto-valeric acid Formula: C19H19FN2O6S MolecularWeight: 422.427363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(C2=CC=CS2)C(=O)NC(CC(=O)O)C(=O)CF

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(C2=CC=CS2)C(=O)NC(CC(=O)O)C(=O)CF

InChI

InChI=1S/C19H19FN2O6S/c20-10-14(23)13(9-16(24)25)21-18(26)17(15-7-4-8-29-15)22-19(27)28-11-12-5-2-1-3-6-12/h1-8,13,17H,9-11H2,(H,21,26)(H,22,27)(H,24,25)