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Details

Stereochemistry ACHIRAL
Molecular Formula C13H9N3O5S
Molecular Weight 319.293
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2,4-Dioxo-1H-pyrido[2,3-d]pyrimidin-3-yl)benzenesulfonate

SMILES

O=C1NC2=C(C=CC=N2)C(=O)N1OS(=O)(=O)C3=CC=CC=C3

InChI

InChIKey=SAXMZEHOQCLGOC-UHFFFAOYSA-N
InChI=1S/C13H9N3O5S/c17-12-10-7-4-8-14-11(10)15-13(18)16(12)21-22(19,20)9-5-2-1-3-6-9/h1-8H,(H,14,15,18)

HIDE SMILES / InChI

Molecular Formula C13H9N3O5S
Molecular Weight 319.293
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 Sat Dec 16 12:42:48 GMT 2023
Edited
by admin
on Sat Dec 16 12:42:48 GMT 2023
Record UNII
2787GS6URN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2,4-Dioxo-1H-pyrido[2,3-d]pyrimidin-3-yl)benzenesulfonate
Systematic Name English
Pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione, 3-[(phenylsulfonyl)oxy]-
Systematic Name English
3-((Phenylsulfonyl)oxy)pyrido(2,3-d)pyrimidine-2,4(1H,3H)-dione
Systematic Name English
NSC-101746
Code English
Code System Code Type Description
EPA CompTox
DTXSID90193339
Created by admin on Sat Dec 16 12:42:48 GMT 2023 , Edited by admin on Sat Dec 16 12:42:48 GMT 2023
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PUBCHEM
265565
Created by admin on Sat Dec 16 12:42:48 GMT 2023 , Edited by admin on Sat Dec 16 12:42:48 GMT 2023
PRIMARY
CAS
40338-52-1
Created by admin on Sat Dec 16 12:42:48 GMT 2023 , Edited by admin on Sat Dec 16 12:42:48 GMT 2023
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FDA UNII
2787GS6URN
Created by admin on Sat Dec 16 12:42:48 GMT 2023 , Edited by admin on Sat Dec 16 12:42:48 GMT 2023
PRIMARY
NSC
101746
Created by admin on Sat Dec 16 12:42:48 GMT 2023 , Edited by admin on Sat Dec 16 12:42:48 GMT 2023
PRIMARY