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Details

Stereochemistry ACHIRAL
Molecular Formula C25H21FIN3O6S
Molecular Weight 637.419
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-[[(4-methylphenyl)sulfonyl]oxy]pyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trione

SMILES

CN1C(=O)C(C)=C(OS(=O)(=O)C2=CC=C(C)C=C2)C3=C1N(C(=O)N(C4CC4)C3=O)C5=C(F)C=C(I)C=C5

InChI

InChIKey=RCCOZJPSLZNDFV-UHFFFAOYSA-N
InChI=1S/C25H21FIN3O6S/c1-13-4-9-17(10-5-13)37(34,35)36-21-14(2)23(31)28(3)22-20(21)24(32)29(16-7-8-16)25(33)30(22)19-11-6-15(27)12-18(19)26/h4-6,9-12,16H,7-8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C25H21FIN3O6S
Molecular Weight 637.419
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 20:56:35 GMT 2025
Edited
by admin
on Wed Apr 02 20:56:35 GMT 2025
Record UNII
HTS9D7XD8D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl 4-methylbenzenesulfonate
Preferred Name English
3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-[[(4-methylphenyl)sulfonyl]oxy]pyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trione
Systematic Name English
Pyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trione, 3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-[[(4-methylphenyl)sulfonyl]oxy]-
Systematic Name English
p-Toluenesulfonic acid 3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl ester
Systematic Name English
Code System Code Type Description
PUBCHEM
59717044
Created by admin on Wed Apr 02 20:56:35 GMT 2025 , Edited by admin on Wed Apr 02 20:56:35 GMT 2025
PRIMARY
FDA UNII
HTS9D7XD8D
Created by admin on Wed Apr 02 20:56:35 GMT 2025 , Edited by admin on Wed Apr 02 20:56:35 GMT 2025
PRIMARY
CAS
871700-32-2
Created by admin on Wed Apr 02 20:56:35 GMT 2025 , Edited by admin on Wed Apr 02 20:56:35 GMT 2025
PRIMARY