3-[2-(1-azanylethyl)-1,3-dithian-2-yl]-4-fluoranyl-2-methyl-butanoic acid

Systemtic Name: 3-[2-(1-azanylethyl)-1,3-dithian-2-yl]-4-fluoranyl-2-methyl-butanoic acid Openeye Name: 3-[2-(1-aminoethyl)-1,3-dithian-2-yl]-4-fluoro-2-methyl-butanoic acid CAS Name: 3-[2-(1-aminoethyl)-1,3-dithian-2-yl]-4-fluoro-2-methylbutanoic acid IUPAC Name: 3-[2-(1-aminoethyl)-1,3-dithian-2-yl]-4-fluoro-2-methylbutanoic acid Traditional Name: 3-[2-(1-aminoethyl)-1,3-dithian-2-yl]-4-fluoro-2-methyl-butyric acid Formula: C11H20FNO2S2 MolecularWeight: 281.410403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CF)C1(SCCCS1)C(C)N)C(=O)O

Isomeric SMILES

CC(C(CF)C1(SCCCS1)C(C)N)C(=O)O

InChI

InChI=1S/C11H20FNO2S2/c1-7(10(14)15)9(6-12)11(8(2)13)16-4-3-5-17-11/h7-9H,3-6,13H2,1-2H3,(H,14,15)