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Details

Stereochemistry ACHIRAL
Molecular Formula C21H16ClF3N4O4
Molecular Weight 480.824
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BAY-721973

SMILES

OCNC(=O)C1=NC=CC(OC2=CC=C(NC(=O)NC3=CC=C(Cl)C(=C3)C(F)(F)F)C=C2)=C1

InChI

InChIKey=HCXYKSDRIWQAMU-UHFFFAOYSA-N
InChI=1S/C21H16ClF3N4O4/c22-17-6-3-13(9-16(17)21(23,24)25)29-20(32)28-12-1-4-14(5-2-12)33-15-7-8-26-18(10-15)19(31)27-11-30/h1-10,30H,11H2,(H,27,31)(H2,28,29,32)

HIDE SMILES / InChI

Molecular Formula C21H16ClF3N4O4
Molecular Weight 480.824
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:12:15 UTC 2023
Edited
by admin
on Sat Dec 16 08:12:15 UTC 2023
Record UNII
83F1Z938Q0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BAY-721973
Common Name English
SORAFENIB METABOLITE M3
Common Name English
HOM-SRF
Common Name English
2-PYRIDINECARBOXAMIDE, 4-(4-((((4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)AMINO)CARBONYL)AMINO)PHENOXY)-N-(HYDROXYMETHYL)-
Systematic Name English
4-(4-(((4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)AMINO)PHENOXY)-N-(HYDROXYMETHYL)PYRIDINE-2-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
CAS
1380310-94-0
Created by admin on Sat Dec 16 08:12:15 UTC 2023 , Edited by admin on Sat Dec 16 08:12:15 UTC 2023
PRIMARY
FDA UNII
83F1Z938Q0
Created by admin on Sat Dec 16 08:12:15 UTC 2023 , Edited by admin on Sat Dec 16 08:12:15 UTC 2023
PRIMARY
PUBCHEM
67424139
Created by admin on Sat Dec 16 08:12:15 UTC 2023 , Edited by admin on Sat Dec 16 08:12:15 UTC 2023
PRIMARY
Related Record Type Details
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