THR-0921

Details

Stereochemistry	RACEMIC
Molecular Formula	C28H25NO7S
Molecular Weight	519.566
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)C(=C\C1=CC(OC)=CC(OC)=C1)\C2=CC=C(OC3=CC=C(CC4SC(=O)NC4=O)C=C3)C=C2

InChI

InChIKey=IVAQJHSXBVHUQT-ZVHZXABRSA-N

InChI=1S/C28H25NO7S/c1-33-22-12-18(13-23(16-22)34-2)14-24(27(31)35-3)19-6-10-21(11-7-19)36-20-8-4-17(5-9-20)15-25-26(30)29-28(32)37-25/h4-14,16,25H,15H2,1-3H3,(H,29,30,32)/b24-14+

HIDE SMILES / InChI

Molecular Formula	C28H25NO7S
Molecular Weight	519.566
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:31:11 GMT 2023` Edited by `admin` on `Fri Dec 15 16:31:11 GMT 2023`
Record UNII	4LXSR6QYJI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

THR-0921

Code

English

BENZENEACETIC ACID, .ALPHA.-((3,5-DIMETHOXYPHENYL)METHYLENE)-4-(4-((2,4-DIOXO-5-THIAZOLIDINYL)METHYL)PHENOXY)-, METHYL ESTER, (.ALPHA.E)-

Systematic Name

English

CLX-0921

Code

English

3-(3,5-DIMETHOXYPHENYL)-2-(4-(4-(2,4-DIOXOTHIAZOLIDIN-5-YLMETHYL)-PHENOXY)-PHENYL)-ACRYLIC ACID METHYL ESTER

Systematic Name

English

Code System Code Type Description

DRUG BANK

DB05854