(2-(5-(2,4-DIOXOPYRIMIDIN-1-YL)-3-(6-(METHANESULFONAMIDO)-2-NAPHTHYL)-2-METHOXY-PHENYL)-2-METHYL-PROPYL) HYDROGEN SULFATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H27N3O9S2
Molecular Weight	589.637
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (2-(5-(2,4-DIOXOPYRIMIDIN-1-YL)-3-(6-(METHANESULFONAMIDO)-2-NAPHTHYL)-2-METHOXY-PHENYL)-2-METHYL-PROPYL) HYDROGEN SULFATE

Structure Search

SMILES

COC1=C(C=C(C=C1C(C)(C)COS(O)(=O)=O)N2C=CC(=O)NC2=O)C3=CC4=CC=C(NS(C)(=O)=O)C=C4C=C3

InChI

InChIKey=XMYHVGRCTWWNCB-UHFFFAOYSA-N

InChI=1S/C26H27N3O9S2/c1-26(2,15-38-40(34,35)36)22-14-20(29-10-9-23(30)27-25(29)31)13-21(24(22)37-3)18-6-5-17-12-19(28-39(4,32)33)8-7-16(17)11-18/h5-14,28H,15H2,1-4H3,(H,27,30,31)(H,34,35,36)

HIDE SMILES / InChI

Molecular Formula	C26H27N3O9S2
Molecular Weight	589.637
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 02:38:22 GMT 2025` Edited by `admin` on `Wed Apr 02 02:38:22 GMT 2025`
Record UNII	UT7V26832A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2-(5-(2,4-DIOXOPYRIMIDIN-1-YL)-3-(6-(METHANESULFONAMIDO)-2-NAPHTHYL)-2-METHOXY-PHENYL)-2-METHYL-PROPYL) HYDROGEN SULFATE

Systematic Name

English

DASABUVIR METABOLITE M2

Preferred Name

English

Code System Code Type Description

FDA UNII

UT7V26832A

Created by admin on Wed Apr 02 02:38:22 GMT 2025 , Edited by admin on Wed Apr 02 02:38:22 GMT 2025

PRIMARY

PUBCHEM

155929102

Created by admin on Wed Apr 02 02:38:22 GMT 2025 , Edited by admin on Wed Apr 02 02:38:22 GMT 2025

PRIMARY

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