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Details

Stereochemistry RACEMIC
Molecular Formula C22H18N4O2S
Molecular Weight 402.4708
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of AXITINIB SULFOXIDE

SMILES

CN=C(c1ccccc1S(=O)c2ccc3c(/C(/[H])=C(\[H])/c4ccccn4)[nH]nc3c2)O

InChI

InChIKey=MAHSNFBPPYMWFB-FMIVXFBMSA-N
InChI=1S/C22H18N4O2S/c1-23-22(27)18-7-2-3-8-21(18)29(28)16-10-11-17-19(25-26-20(17)14-16)12-9-15-6-4-5-13-24-15/h2-14H,1H3,(H,23,27)(H,25,26)/b12-9+

HIDE SMILES / InChI

Molecular Formula C22H18N4O2S
Molecular Weight 402.4708
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 08:26:52 UTC 2021
Edited
by admin
on Sat Jun 26 08:26:52 UTC 2021
Record UNII
55P8GY3IEK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AXITINIB SULFOXIDE
Common Name English
BENZAMIDE, N-METHYL-2-((3-((1E)-2-(2-PYRIDINYL)ETHENYL)-1H-INDAZOL-6-YL)SULFINYL)
Systematic Name English
PF-03482595
Code English
AXITINIB METABOLITE M12
Common Name English
AG-028458
Code English
Classification Tree Code System Code
NDF-RT N0000175605
Created by admin on Sat Jun 26 08:26:52 UTC 2021 , Edited by admin on Sat Jun 26 08:26:52 UTC 2021
Code System Code Type Description
FDA UNII
55P8GY3IEK
Created by admin on Sat Jun 26 08:26:52 UTC 2021 , Edited by admin on Sat Jun 26 08:26:52 UTC 2021
PRIMARY
CAS
1347304-18-0
Created by admin on Sat Jun 26 08:26:52 UTC 2021 , Edited by admin on Sat Jun 26 08:26:52 UTC 2021
PRIMARY
PUBCHEM
86278350
Created by admin on Sat Jun 26 08:26:52 UTC 2021 , Edited by admin on Sat Jun 26 08:26:52 UTC 2021
PRIMARY
Related Record Type Details
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URINE