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Details

Stereochemistry ACHIRAL
Molecular Formula C26H25N3O7S
Molecular Weight 523.558
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of A-1039710

SMILES

COC1=C(C=C(C=C1C2=CC3=CC=C(NS(C)(=O)=O)C=C3C=C2)N4C=CC(=O)NC4=O)C(C)(C)C(O)=O

InChI

InChIKey=MTNFZAKOJUMHNX-UHFFFAOYSA-N
InChI=1S/C26H25N3O7S/c1-26(2,24(31)32)21-14-19(29-10-9-22(30)27-25(29)33)13-20(23(21)36-3)17-6-5-16-12-18(28-37(4,34)35)8-7-15(16)11-17/h5-14,28H,1-4H3,(H,31,32)(H,27,30,33)

HIDE SMILES / InChI

Molecular Formula C26H25N3O7S
Molecular Weight 523.558
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 15:16:56 UTC 2023
Edited
by admin
on Sat Dec 16 15:16:56 UTC 2023
Record UNII
105BZ2BR3N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
A-1039710
Code English
5-(3,4-DIHYDRO-2,4-DIOXO-1(2H)-PYRIMIDINYL)-2-METHOXY-.ALPHA.,.ALPHA.-DIMETHYL-3-(6-((METHYLSULFONYL)AMINO)-2-NAPHTHALENYL)BENZENEACETIC ACID
Systematic Name English
DASABUVIR METABOLITE M5
Common Name English
BENZENEACETIC ACID, 5-(3,4-DIHYDRO-2,4-DIOXO-1(2H)-PYRIMIDINYL)-2-METHOXY-.ALPHA.,.ALPHA.-DIMETHYL-3-(6-((METHYLSULFONYL)AMINO)-2-NAPHTHALENYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
25234279
Created by admin on Sat Dec 16 15:16:56 UTC 2023 , Edited by admin on Sat Dec 16 15:16:56 UTC 2023
PRIMARY
FDA UNII
105BZ2BR3N
Created by admin on Sat Dec 16 15:16:56 UTC 2023 , Edited by admin on Sat Dec 16 15:16:56 UTC 2023
PRIMARY
CAS
1132936-19-6
Created by admin on Sat Dec 16 15:16:56 UTC 2023 , Edited by admin on Sat Dec 16 15:16:56 UTC 2023
PRIMARY
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