EMRICASAN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H27F4N3O7
Molecular Weight	569.5021
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H](NC(=O)C(=O)NC1=C(C=CC=C1)C(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)COC2=C(F)C(F)=CC(F)=C2F

InChI

InChIKey=SCVHJVCATBPIHN-SJCJKPOMSA-N

InChI=1S/C26H27F4N3O7/c1-12(31-24(38)25(39)32-16-8-6-5-7-13(16)26(2,3)4)23(37)33-17(10-19(35)36)18(34)11-40-22-20(29)14(27)9-15(28)21(22)30/h5-9,12,17H,10-11H2,1-4H3,(H,31,38)(H,32,39)(H,33,37)(H,35,36)/t12-,17-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H27F4N3O7
Molecular Weight	569.5021
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:40:39 UTC 2023` Edited by `admin` on `Sat Dec 16 17:40:39 UTC 2023`
Record UNII	P0GMS9N47Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

EMRICASAN

Official Name

English

L-ALANINAMIDE, N-(2-(1,1-DIMETHYLETHYL)PHENYL)-2-OXOGLYCYL-N-((1S)-1-(CARBOXYMETHYL)-2-OXO-3-(2,3,5,6-TETRAFLUOROPHENOXY)PROPYL)-

Systematic Name

English

IDN 6556

Code

English

PF 03491390

Code

English

VAY-785

Code

English

emricasan [INN]

Common Name

English

EMRICASAN [USAN]

Common Name

English

PF-03491390

Code

English

(3S)-3-(N2-((2-TERT-BUTYLPHENYL)OXAMOYL)-L-ALANINAMIDO)-4-OXO-5-(2,3,5,6-TETRAFLUOROPHENOXY)PENTANOIC ACID

Systematic Name

English

(3S)-3-((2S)-2-((N-(2-TERT-BUTYL)PHENYL)CARBAMOYL)CARBONYLAMINO) PROPANOYLAMINO)-4-OXO-5-(2,3,5,6-TETRAFLUOROPHENOXY)PENTANOIC ACID

Systematic Name

English

Emricasan [WHO-DD]

Common Name

English

IDN-6556

Code

English

VAY785

Code

English

Classification Tree Code System Code

FDA ORPHAN DRUG

169603