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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > nitro compound > c-nitro compound > 4,5-dimethyl-2-[4-(3-nitrophenyl)-2-thiazolyl]-1h-pyrazol-3-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > c-nitro compound > 4,5-dimethyl-2-[4-(3-nitrophenyl)-2-thiazolyl]-1h-pyrazol-3-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > 4,5-dimethyl-2-[4-(3-nitrophenyl)-2-thiazolyl]-1h-pyrazol-3-one

Preferred term

4,5-dimethyl-2-[4-(3-nitrophenyl)-2-thiazolyl]-1h-pyrazol-3-one  

Type

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

Broader concept

charge

  • 0

formula

  • C14H12N4O3S

inchi

  • InChI=1S/C14H12N4O3S/c1-8-9(2)16-17(13(8)19)14-15-12(7-22-14)10-4-3-5-11(6-10)18(20)21/h3-7,16H,1-2H3

inchikey

  • HLMSNQZZJAMDED-UHFFFAOYSA-N

mass

  • 316.337

monoisotopicmass

  • 316.06301

smiles

  • CC1=C(NN(C1=O)C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:115574

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