(5S)-6-(BENZOFURAN-4-CARBONYLAMINO)-5-((5-(4-FLUOROPHENYL)-2-METHYL-THIAZOLE-4-CARBONYL)AMINO)HEXANOIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H24FN3O5S
Molecular Weight	509.549
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (5S)-6-(BENZOFURAN-4-CARBONYLAMINO)-5-((5-(4-FLUOROPHENYL)-2-METHYL-THIAZOLE-4-CARBONYL)AMINO)HEXANOIC ACID

Structure Search

SMILES

CC1=NC(C(=O)N[C@@H](CCCC(O)=O)CNC(=O)C2=CC=CC3=C2C=CO3)=C(S1)C4=CC=C(F)C=C4

InChI

InChIKey=VLUYKCJYPNEQDD-SFHVURJKSA-N

InChI=1S/C26H24FN3O5S/c1-15-29-23(24(36-15)16-8-10-17(27)11-9-16)26(34)30-18(4-2-7-22(31)32)14-28-25(33)20-5-3-6-21-19(20)12-13-35-21/h3,5-6,8-13,18H,2,4,7,14H2,1H3,(H,28,33)(H,30,34)(H,31,32)/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H24FN3O5S
Molecular Weight	509.549
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 07:24:14 GMT 2025` Edited by `admin` on `Wed Apr 02 07:24:14 GMT 2025`
Record UNII	BF9TT85M2M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(5S)-6-(BENZOFURAN-4-CARBONYLAMINO)-5-((5-(4-FLUOROPHENYL)-2-METHYL-THIAZOLE-4-CARBONYL)AMINO)HEXANOIC ACID

Systematic Name

English

SB-649868 METABOLITE M32

Preferred Name

English

Code System Code Type Description

PUBCHEM

118753125

Created by admin on Wed Apr 02 07:24:14 GMT 2025 , Edited by admin on Wed Apr 02 07:24:14 GMT 2025

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FDA UNII

BF9TT85M2M

Created by admin on Wed Apr 02 07:24:14 GMT 2025 , Edited by admin on Wed Apr 02 07:24:14 GMT 2025

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