Concept information
Preferred term
N [[(2S,3R) 8 (dimethylamino) 5 [(2R) 1 hydroxypropan 2 yl] 3 methyl 6 oxo 3,4 dihydro 2H 1,5 benzoxazocin 2 yl]methyl] N,1 dimethyl 4 imidazolesulfonamide
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C22H33N5O5S
inchi
- InChI=1S/C22H33N5O5S/c1-15-10-27(16(2)13-28)22(29)18-9-17(24(3)4)7-8-19(18)32-20(15)11-26(6)33(30,31)21-12-25(5)14-23-21/h7-9,12,14-16,20,28H,10-11,13H2,1-6H3/t15-,16-,20-/m1/s1
inchikey
- IMQZVRHTFBCMDC-JXXFODFXSA-N
mass
- 479.595
monoisotopicmass
- 479.22024
smiles
- C[C@@H]1CN(C(=O)C2=C(C=CC(=C2)N(C)C)O[C@@H]1CN(C)S(=O)(=O)C3=CN(C=N3)C)[C@H](C)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:124883
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