A-1039710

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 Search

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 GMT 2023` Edited by `admin` on `Sat Dec 16 15:16:56 GMT 2023`
Record UNII	105BZ2BR3N
Record Status	`Validated (UNII)`
Record Version

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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 GMT 2023 , Edited by admin on Sat Dec 16 15:16:56 GMT 2023

PRIMARY

FDA UNII

105BZ2BR3N

Created by admin on Sat Dec 16 15:16:56 GMT 2023 , Edited by admin on Sat Dec 16 15:16:56 GMT 2023

PRIMARY

CAS

1132936-19-6

Created by admin on Sat Dec 16 15:16:56 GMT 2023 , Edited by admin on Sat Dec 16 15:16:56 GMT 2023

PRIMARY

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