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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > ar-a014418

Preferred term

ar-a014418  

Type

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

Broader concept

charge

  • 0

formula

  • C12H12N4O4S

inchi

  • InChI=1S/C12H12N4O4S/c1-20-9-4-2-8(3-5-9)6-13-11(17)15-12-14-7-10(21-12)16(18)19/h2-5,7H,6H2,1H3,(H2,13,14,15,17)

inchikey

  • YAEMHJKFIIIULI-UHFFFAOYSA-N

mass

  • 308.310

monoisotopicmass

  • 308.05793

smiles

  • COC1=CC=C(C=C1)C/N=C(/NC2=NC=C([N+]([O-])=O)S2)/O

subset

  • 2_STAR

synonym EXACT

  • 1-[(4-methoxyphenyl)methyl]-3-(5-nitro-1,3-thiazol-2-yl)urea

synonym RELATED

  • AR-AO14418

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:232162

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