2-(5-(2,4-DIOXOHEXAHYDROPYRIMIDIN-1-YL)-3-(6-(METHANESULFONAMIDO)-2-NAPHTHYL)-2-METHOXY-PHENYL)-2-METHYL-PROPANOIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H27N3O7S
Molecular Weight	525.573
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(5-(2,4-DIOXOHEXAHYDROPYRIMIDIN-1-YL)-3-(6-(METHANESULFONAMIDO)-2-NAPHTHYL)-2-METHOXY-PHENYL)-2-METHYL-PROPANOIC ACID

Structure Search

SMILES

COC1=C(C=C(C=C1C2=CC3=CC=C(NS(C)(=O)=O)C=C3C=C2)N4CCC(=O)NC4=O)C(C)(C)C(O)=O

InChI

InChIKey=CRKUGGXXEUFMFV-UHFFFAOYSA-N

InChI=1S/C26H27N3O7S/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/h5-8,11-14,28H,9-10H2,1-4H3,(H,31,32)(H,27,30,33)

HIDE SMILES / InChI

Molecular Formula	C26H27N3O7S
Molecular Weight	525.573
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 14:33:36 GMT 2023` Edited by `admin` on `Sat Dec 16 14:33:36 GMT 2023`
Record UNII	7H26EC52D6
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2-(5-(2,4-DIOXOHEXAHYDROPYRIMIDIN-1-YL)-3-(6-(METHANESULFONAMIDO)-2-NAPHTHYL)-2-METHOXY-PHENYL)-2-METHYL-PROPANOIC ACID

Systematic Name

English

DASABUVIR METABOLITE M8

Common Name

English

Code System Code Type Description

FDA UNII

7H26EC52D6

Created by admin on Sat Dec 16 14:33:36 GMT 2023 , Edited by admin on Sat Dec 16 14:33:36 GMT 2023

PRIMARY

PUBCHEM

74411338

Created by admin on Sat Dec 16 14:33:36 GMT 2023 , Edited by admin on Sat Dec 16 14:33:36 GMT 2023

PRIMARY

Related Record Type Details


					DE54EQW8T1

DASABUVIR

PARENT -> METABOLITE

Qualification:

FECAL

Amount: