2-(2-acetamidophenyl)sulfanylpentanoic acid

Systemtic Name: 2-(2-acetamidophenyl)sulfanylpentanoic acid Openeye Name: 2-(2-acetamidophenyl)sulfanylpentanoic acid CAS Name: 2-[(2-acetamidophenyl)thio]pentanoic acid IUPAC Name: 2-(2-acetamidophenyl)sulfanylpentanoic acid Traditional Name: 2-[(2-acetamidophenyl)thio]valeric acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3S/c1-3-6-12(13(16)17)18-11-8-5-4-7-10(11)14-9(2)15/h4-5,7-8,12H,3,6H2,1-2H3,(H,14,15)(H,16,17)