Concept information
Preferred term
(2R) 2 [(4R,5R) 5 [(dimethylamino)methyl] 8 [2 (3 methoxyphenyl)etynyl] 4 methyl 1,1 dioxo 4,5 dihydro 3H 6,1$l^/{6/},2 benzoxathiazocin 2 yl] 1 propan
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C25H32N2O5S
inchi
- InChI=1S/C25H32N2O5S/c1-18-15-27(19(2)17-28)33(29,30)25-12-11-21(14-23(25)32-24(18)16-26(3)4)10-9-20-7-6-8-22(13-20)31-5/h6-8,11-14,18-19,24,28H,15-17H2,1-5H3/t18-,19-,24+/m1/s1
inchikey
- NGSVTCXVDNQXPV-IECBHUPTSA-N
mass
- 472.599
monoisotopicmass
- 472.20319
smiles
- C[C@@H]1CN(S(=O)(=O)C2=C(C=C(C=C2)C#CC3=CC(=CC=C3)OC)O[C@H]1CN(C)C)[C@H](C)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:125848
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