skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > qqh
organooxygen compound > qqh

Preferred term

qqh  

Type

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

Broader concept

charge

  • 0

formula

  • C19H22N2O3S

has_functional_parent

inchi

  • InChI=1S/C19H22N2O3S/c1-11-6-5-7-13(12(11)2)8-14-9-16(22)21-15(19(23)24)10-25-18(21)17(14)20(3)4/h5-7,9,15H,8,10H2,1-4H3,(H,23,24)/t15-/m0/s1

inchikey

  • ROYOKFGWFIQXTM-HNNXBMFYSA-N

mass

  • 358.460

monoisotopicmass

  • 358.13511

smiles

  • S1C=2N([C@@H](C1)C(O)=O)C(=O)C=C(C2N(C)C)CC=3C(=C(C=CC3)C)C

subset

  • 2_STAR

synonym EXACT

  • (3R)-8-(dimethylamino)-7-[(2,3-dimethylphenyl)methyl]-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:228550

Download this concept:

RDF/XML TURTLE JSON-LD