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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 2-chloro-n-[5-ethyl-3-[(4-methylphenyl)-oxomethyl]-2-thiophenyl]acetamide

Preferred term

2-chloro-n-[5-ethyl-3-[(4-methylphenyl)-oxomethyl]-2-thiophenyl]acetamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C16H16ClNO2S

inchi

  • InChI=1S/C16H16ClNO2S/c1-3-12-8-13(16(21-12)18-14(19)9-17)15(20)11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H,18,19)

inchikey

  • RUOYSSXJCXTPGP-UHFFFAOYSA-N

mass

  • 321.823

monoisotopicmass

  • 321.05903

smiles

  • CCC1=CC(=C(S1)NC(=O)CCl)C(=O)C2=CC=C(C=C2)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116708

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