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Concept information

Preferred term

3 [(4R,5R) 2 [(2R) 1 hydroxypropan 2 yl] 4 methyl 5 (methylaminomethyl) 1,1 dioxo 4,5 dihydro 3H 6,1$l^/{6/},2 benzoxathiazocin 8 yl] N,N دی متیل بنزامید  

Type

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

Broader concept

charge

  • 0

formula

  • C24H33N3O5S

inchi

  • InChI=1S/C24H33N3O5S/c1-16-14-27(17(2)15-28)33(30,31)23-10-9-19(12-21(23)32-22(16)13-25-3)18-7-6-8-20(11-18)24(29)26(4)5/h6-12,16-17,22,25,28H,13-15H2,1-5H3/t16-,17-,22+/m1/s1

inchikey

  • BXSLUDILSQPBHO-YVHKJVDXSA-N

mass

  • 475.603

monoisotopicmass

  • 475.21409

smiles

  • C[C@@H]1CN(S(=O)(=O)C2=C(C=C(C=C2)C3=CC(=CC=C3)C(=O)N(C)C)O[C@H]1CNC)[C@H](C)CO

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:103805

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