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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic amide > dasatinib n-oxide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > aromatic amide > dasatinib n-oxide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic amide > dasatinib n-oxide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > aromatic amide > dasatinib n-oxide

Preferred term

dasatinib n-oxide  

Type

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

Broader concept

charge

  • 0

formula

  • C22H26ClN7O3S

inchi

  • InChI=1S/C22H26ClN7O3S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(34-17)27-18-12-19(26-15(2)25-18)29-6-8-30(33,9-7-29)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)

inchikey

  • UEFNEEZCTQCRAW-UHFFFAOYSA-N

mass

  • 504.010

monoisotopicmass

  • 503.15064

smiles

  • ClC=1C(NC(=O)C=2SC(NC=3N=C(N=C(N4CC[N+]([O-])(CC4)CCO)C3)C)=NC2)=C(C=CC1)C

subset

  • 2_STAR

synonym EXACT

  • N-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-hydroxyethyl)-4-oxidopiperazin-4-ium-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184036

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