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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > triazolopyrimidines > 3-[(2-chlorophenyl)methyl]-7-oxo-n-(thiophen-2-ylmethyl)-2h-triazolo[4,5-d]pyrimidine-5-carboxamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > triazolopyrimidines > 3-[(2-chlorophenyl)methyl]-7-oxo-n-(thiophen-2-ylmethyl)-2h-triazolo[4,5-d]pyrimidine-5-carboxamide

Preferred term

3-[(2-chlorophenyl)methyl]-7-oxo-n-(thiophen-2-ylmethyl)-2h-triazolo[4,5-d]pyrimidine-5-carboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C17H13ClN6O2S

inchi

  • InChI=1S/C17H13ClN6O2S/c18-12-6-2-1-4-10(12)9-24-15-13(22-23-24)16(25)21-14(20-15)17(26)19-8-11-5-3-7-27-11/h1-7,23H,8-9H2,(H,19,26)

inchikey

  • AXVRNDXVAJHHAN-UHFFFAOYSA-N

mass

  • 400.844

monoisotopicmass

  • 400.05092

smiles

  • C1=CC=C(C(=C1)CN2C3=NC(=NC(=O)C3=NN2)C(=O)NCC4=CC=CS4)Cl

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:121111

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