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Chemistry, part 1

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Concept information

organic aromatic compound > aromatic amine > lsm-39047
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > aromatic amine > lsm-39047
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > aromatic amine > lsm-39047

Preferred term

lsm-39047  

Type

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

Broader concept

charge

  • 0

formula

  • C25H33FN2O4S

inchi

  • InChI=1S/C25H33FN2O4S/c1-5-8-20-11-12-25-23(13-20)32-24(16-27(4)15-21-9-6-7-10-22(21)26)18(2)14-28(19(3)17-29)33(25,30)31/h5-13,18-19,24,29H,14-17H2,1-4H3/t18-,19-,24-/m1/s1

inchikey

  • YOCBOZXTNPBXJL-KHCICDEESA-N

mass

  • 476.606

monoisotopicmass

  • 476.21451

smiles

  • CC=CC1=CC2=C(C=C1)S(=O)(=O)N(C[C@H]([C@H](O2)CN(C)CC3=CC=CC=C3F)C)[C@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:127489

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