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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ether > aromatic ether > 3-[(4-ethylphenoxy)methyl]-4-(6-methylheptan-2-yl)-1h-1,2,4-triazole-5-thione
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic ether > 3-[(4-ethylphenoxy)methyl]-4-(6-methylheptan-2-yl)-1h-1,2,4-triazole-5-thione
... > 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 ether > 3-[(4-ethylphenoxy)methyl]-4-(6-methylheptan-2-yl)-1h-1,2,4-triazole-5-thione
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > 3-[(4-ethylphenoxy)methyl]-4-(6-methylheptan-2-yl)-1h-1,2,4-triazole-5-thione

Preferred term

3-[(4-ethylphenoxy)methyl]-4-(6-methylheptan-2-yl)-1h-1,2,4-triazole-5-thione  

Type

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

Broader concept

charge

  • 0

formula

  • C19H29N3OS

inchi

  • InChI=1S/C19H29N3OS/c1-5-16-9-11-17(12-10-16)23-13-18-20-21-19(24)22(18)15(4)8-6-7-14(2)3/h9-12,14-15H,5-8,13H2,1-4H3,(H,21,24)

inchikey

  • GCWFBJNERWTBLJ-UHFFFAOYSA-N

mass

  • 347.520

monoisotopicmass

  • 347.20313

smiles

  • CCC1=CC=C(C=C1)OCC2=NNC(=S)N2C(C)CCCC(C)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:113146

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