N-(3-(((3S,4R)-6-((5,6-DIFLUORO-1,3-BENZOTHIAZOL-2-YL)METHOXY)-2,4-DIHYDROXY-CHROMAN-3-YL)METHYL)-4-METHOXY-PHENYL)-1,1,1-TRIFLUORO-METHANESULFONAMIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C26H21F5N2O7S2
Molecular Weight	632.576
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-(3-(((3S,4R)-6-((5,6-DIFLUORO-1,3-BENZOTHIAZOL-2-YL)METHOXY)-2,4-DIHYDROXY-CHROMAN-3-YL)METHYL)-4-METHOXY-PHENYL)-1,1,1-TRIFLUORO-METHANESULFONAMIDE

Structure Search

SMILES

COC1=C(C[C@@H]2C(O)OC3=C(C=C(OCC4=NC5=CC(F)=C(F)C=C5S4)C=C3)[C@@H]2O)C=C(NS(=O)(=O)C(F)(F)F)C=C1

InChI

InChIKey=LHUAGJAAMPJFHA-OOEFIEHDSA-N

InChI=1S/C26H21F5N2O7S2/c1-38-20-4-2-13(33-42(36,37)26(29,30)31)6-12(20)7-16-24(34)15-8-14(3-5-21(15)40-25(16)35)39-11-23-32-19-9-17(27)18(28)10-22(19)41-23/h2-6,8-10,16,24-25,33-35H,7,11H2,1H3/t16-,24-,25?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H21F5N2O7S2
Molecular Weight	632.576
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:01:23 GMT 2023` Edited by `admin` on `Sat Dec 16 18:01:23 GMT 2023`
Record UNII	U99DB5Q5FF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-(3-(((3S,4R)-6-((5,6-DIFLUORO-1,3-BENZOTHIAZOL-2-YL)METHOXY)-2,4-DIHYDROXY-CHROMAN-3-YL)METHYL)-4-METHOXY-PHENYL)-1,1,1-TRIFLUORO-METHANESULFONAMIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

165412064

Created by admin on Sat Dec 16 18:01:23 GMT 2023 , Edited by admin on Sat Dec 16 18:01:23 GMT 2023

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FDA UNII

U99DB5Q5FF

Created by admin on Sat Dec 16 18:01:23 GMT 2023 , Edited by admin on Sat Dec 16 18:01:23 GMT 2023

PRIMARY

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