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Details

Stereochemistry ACHIRAL
Molecular Formula C21H14F4N4O3S
Molecular Weight 478.419
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 4-(7-(6-cyano-5-(trifluoromethyl)pyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspiro[3.4]octan-5-yl)-2-fluorobenzoate

SMILES

COC(=O)C1=C(F)C=C(C=C1)N2C(=S)N(C(=O)C23CCC3)C4=CC(=C(N=C4)C#N)C(F)(F)F

InChI

InChIKey=KCBBUMNCDVJYDW-UHFFFAOYSA-N
InChI=1S/C21H14F4N4O3S/c1-32-17(30)13-4-3-11(8-15(13)22)29-19(33)28(18(31)20(29)5-2-6-20)12-7-14(21(23,24)25)16(9-26)27-10-12/h3-4,7-8,10H,2,5-6H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Methyl 4-(7-(6-cyano-5-(trifluoromethyl)pyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspiro[3.4]octan-5-yl)-2-fluorobenzoate
Systematic Name English
Methyl 4-[7-[6-cyano-5-(trifluoromethyl)-3-pyridinyl]-8-oxo-6-thioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluorobenzoate
Systematic Name English
Benzoic acid, 4-[7-[6-cyano-5-(trifluoromethyl)-3-pyridinyl]-8-oxo-6-thioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-, methyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
67WX8FU9YU
Created by admin on Sat Dec 16 19:21:07 GMT 2023 , Edited by admin on Sat Dec 16 19:21:07 GMT 2023
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PUBCHEM
90284890
Created by admin on Sat Dec 16 19:21:07 GMT 2023 , Edited by admin on Sat Dec 16 19:21:07 GMT 2023
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CAS
1950587-19-5
Created by admin on Sat Dec 16 19:21:07 GMT 2023 , Edited by admin on Sat Dec 16 19:21:07 GMT 2023
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