3-(4-acetamidophenyl)sulfanylheptanoic acid

Systemtic Name: 3-(4-acetamidophenyl)sulfanylheptanoic acid Openeye Name: 3-(4-acetamidophenyl)sulfanylheptanoic acid CAS Name: 3-[(4-acetamidophenyl)thio]heptanoic acid IUPAC Name: 3-(4-acetamidophenyl)sulfanylheptanoic acid Traditional Name: 3-[(4-acetamidophenyl)thio]enanthic acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)O)SC1=CC=C(C=C1)NC(=O)C

Isomeric SMILES

CCCCC(CC(=O)O)SC1=CC=C(C=C1)NC(=O)C

InChI

InChI=1S/C15H21NO3S/c1-3-4-5-14(10-15(18)19)20-13-8-6-12(7-9-13)16-11(2)17/h6-9,14H,3-5,10H2,1-2H3,(H,16,17)(H,18,19)