2-[2-(propanoylamino)phenyl]sulfanylpentanoic acid

Systemtic Name: 2-[2-(propanoylamino)phenyl]sulfanylpentanoic acid Openeye Name: 2-[2-(propanoylamino)phenyl]sulfanylpentanoic acid CAS Name: 2-[[2-(1-oxopropylamino)phenyl]thio]pentanoic acid IUPAC Name: 2-[2-(propanoylamino)phenyl]sulfanylpentanoic acid Traditional Name: 2-[(2-propionamidophenyl)thio]valeric acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)SC1=CC=CC=C1NC(=O)CC

Isomeric SMILES

CCCC(C(=O)O)SC1=CC=CC=C1NC(=O)CC

InChI

InChI=1S/C14H19NO3S/c1-3-7-12(14(17)18)19-11-9-6-5-8-10(11)15-13(16)4-2/h5-6,8-9,12H,3-4,7H2,1-2H3,(H,15,16)(H,17,18)