U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C21H22BrFN4O2
Molecular Weight 461.327
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-DESMETHYL VANDETANIB

SMILES

COC1=CC2=C(C=C1OCC3CCNCC3)N=CN=C2NC4=CC=C(Br)C=C4F

InChI

InChIKey=HTCPERSEGREUFC-UHFFFAOYSA-N
InChI=1S/C21H22BrFN4O2/c1-28-19-9-15-18(10-20(19)29-11-13-4-6-24-7-5-13)25-12-26-21(15)27-17-3-2-14(22)8-16(17)23/h2-3,8-10,12-13,24H,4-7,11H2,1H3,(H,25,26,27)

HIDE SMILES / InChI

Approval Year

Name Type Language
N-DESMETHYL VANDETANIB
Common Name English
N-DESMETHYL-ZD6474
Code English
4-(4-BROMO-2-FLUOROANILINO)-6-METHOXY-7-((PIPERIDIN-4-YL)METHOXY)QUINAZOLINE
Systematic Name English
4-QUINAZOLINAMINE, N-(4-BROMO-2-FLUOROPHENYL)-6-METHOXY-7-(4-PIPERIDINYLMETHOXY)-
Systematic Name English
M382558
Code English
N-DESMETHYL METABOLITE OF VANDETANIB
Common Name English
N-DESMETHYLVANDETANIB
Common Name English
J1.720.299E
Code English
Code System Code Type Description
EPA CompTox
DTXSID50416177
Created by admin on Sat Dec 16 10:48:43 GMT 2023 , Edited by admin on Sat Dec 16 10:48:43 GMT 2023
PRIMARY
PUBCHEM
5329048
Created by admin on Sat Dec 16 10:48:43 GMT 2023 , Edited by admin on Sat Dec 16 10:48:43 GMT 2023
PRIMARY
CAS
338992-12-4
Created by admin on Sat Dec 16 10:48:43 GMT 2023 , Edited by admin on Sat Dec 16 10:48:43 GMT 2023
PRIMARY
FDA UNII
K4I43R5TNP
Created by admin on Sat Dec 16 10:48:43 GMT 2023 , Edited by admin on Sat Dec 16 10:48:43 GMT 2023
PRIMARY