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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > halide > organohalogen compound > organochlorine compound > chlorobenzenes > dichlorobenzene > 2-[(2-amino-4,5-dimethyl-3-furanyl)sulfonyl]-3-(3,5-dichlorophenyl)-2-propenenitrile
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > benzenes > chlorobenzenes > dichlorobenzene > 2-[(2-amino-4,5-dimethyl-3-furanyl)sulfonyl]-3-(3,5-dichlorophenyl)-2-propenenitrile
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > benzenes > chlorobenzenes > dichlorobenzene > 2-[(2-amino-4,5-dimethyl-3-furanyl)sulfonyl]-3-(3,5-dichlorophenyl)-2-propenenitrile

Preferred term

2-[(2-amino-4,5-dimethyl-3-furanyl)sulfonyl]-3-(3,5-dichlorophenyl)-2-propenenitrile  

Type

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

Broader concept

charge

  • 0

formula

  • C15H12Cl2N2O3S

inchi

  • InChI=1S/C15H12Cl2N2O3S/c1-8-9(2)22-15(19)14(8)23(20,21)13(7-18)5-10-3-11(16)6-12(17)4-10/h3-6H,19H2,1-2H3

inchikey

  • VXDZPPNEVUVXEP-UHFFFAOYSA-N

mass

  • 371.240

monoisotopicmass

  • 369.99457

smiles

  • CC1=C(OC(=C1S(=O)(=O)C(=CC2=CC(=CC(=C2)Cl)Cl)C#N)N)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:94081

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