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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > organic sulfide > 6-amino-3-(methoxymethyl)-5-spiro[2h-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > cyanides > nitrile > 6-amino-3-(methoxymethyl)-5-spiro[2h-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > organosulfur heterocyclic compound > 6-amino-3-(methoxymethyl)-5-spiro[2h-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile
organic heterocyclic compound > organosulfur heterocyclic compound > 6-amino-3-(methoxymethyl)-5-spiro[2h-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile

Preferred term

6-amino-3-(methoxymethyl)-5-spiro[2h-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile  

Type

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

Broader concept

charge

  • 0

formula

  • C13H16N4O2S

inchi

  • InChI=1S/C13H16N4O2S/c1-18-7-9-10-12(17-16-9)19-11(15)8(6-14)13(10)2-4-20-5-3-13/h2-5,7,15H2,1H3,(H,16,17)

inchikey

  • WNXWUQRVNFZHIJ-UHFFFAOYSA-N

mass

  • 292.358

smiles

  • COCC1=C2C(=NN1)OC(=C(C23CCSCC3)C#N)N

subset

  • 2_STAR

synonym EXACT

  • 6-amino-3-(methoxymethyl)-2',3',5',6'-tetrahydro-2H-spiro[pyrano[2,3-c]pyrazole-4,4'-thiopyran]-5-carbonitrile

synonym RELATED

  • BRD-K34394171

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116742

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