2-[3-(4-fluorophenyl)sulfanylpropanoylamino]pentanoic acid

Systemtic Name: 2-[3-(4-fluorophenyl)sulfanylpropanoylamino]pentanoic acid Openeye Name: 2-[3-(4-fluorophenyl)sulfanylpropanoylamino]pentanoic acid CAS Name: 2-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]pentanoic acid IUPAC Name: 2-[3-(4-fluorophenyl)sulfanylpropanoylamino]pentanoic acid Traditional Name: 2-[3-[(4-fluorophenyl)thio]propanoylamino]valeric acid Formula: C14H18FNO3S MolecularWeight: 299.361023

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)CCSC1=CC=C(C=C1)F

Isomeric SMILES

CCCC(C(=O)O)NC(=O)CCSC1=CC=C(C=C1)F

InChI

InChI=1S/C14H18FNO3S/c1-2-3-12(14(18)19)16-13(17)8-9-20-11-6-4-10(15)5-7-11/h4-7,12H,2-3,8-9H2,1H3,(H,16,17)(H,18,19)