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Details

Stereochemistry ACHIRAL
Molecular Formula C27H21BrF2N6O5S
Molecular Weight 659.459
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-[4-[5-(Bromomethyl)-1-[(2,6-difluorophenyl)methyl]-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-N?-methoxyurea

SMILES

CONC(=O)NC1=CC=C(C=C1)C2=C(CBr)C3=C(S2)N(CC4=C(F)C=CC=C4F)C(=O)N(C3=O)C5=NN=C(OC)C=C5

InChI

InChIKey=OHSXIULICDZKSJ-UHFFFAOYSA-N
InChI=1S/C27H21BrF2N6O5S/c1-40-21-11-10-20(32-33-21)36-24(37)22-16(12-28)23(14-6-8-15(9-7-14)31-26(38)34-41-2)42-25(22)35(27(36)39)13-17-18(29)4-3-5-19(17)30/h3-11H,12-13H2,1-2H3,(H2,31,34,38)

HIDE SMILES / InChI

Molecular Formula C27H21BrF2N6O5S
Molecular Weight 659.459
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:54:49 GMT 2025
Edited
by admin
on Wed Apr 02 19:54:49 GMT 2025
Record UNII
MY8TK2L956
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Urea, N-[4-[5-(bromomethyl)-1-[(2,6-difluorophenyl)methyl]-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-N?-methoxy-
Preferred Name English
N-[4-[5-(Bromomethyl)-1-[(2,6-difluorophenyl)methyl]-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-N?-methoxyurea
Systematic Name English
Code System Code Type Description
FDA UNII
MY8TK2L956
Created by admin on Wed Apr 02 19:54:49 GMT 2025 , Edited by admin on Wed Apr 02 19:54:49 GMT 2025
PRIMARY
CAS
2681381-07-5
Created by admin on Wed Apr 02 19:54:49 GMT 2025 , Edited by admin on Wed Apr 02 19:54:49 GMT 2025
PRIMARY