ALVELESTAT

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H22F3N5O4S
Molecular Weight	545.533
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1N=CC=C1C2=C(C)N(C(=O)C(=C2)C(=O)NCC3=NC=C(C=C3)S(C)(=O)=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChIKey=QNQZWEGMKJBHEM-UHFFFAOYSA-N

InChI=1S/C25H22F3N5O4S/c1-15-20(22-9-10-31-32(22)2)12-21(23(34)30-13-17-7-8-19(14-29-17)38(3,36)37)24(35)33(15)18-6-4-5-16(11-18)25(26,27)28/h4-12,14H,13H2,1-3H3,(H,30,34)

HIDE SMILES / InChI

Molecular Formula	C25H22F3N5O4S
Molecular Weight	545.533
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 `Fri Dec 15 19:16:22 UTC 2023` Edited by `admin` on `Fri Dec 15 19:16:22 UTC 2023`
Record UNII	6Y5629322X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALVELESTAT

Official Name

English

N-((5-(METHANESULFONYL)PYRIDIN-2-YL)METHYL)-6-METHYL-5-(1-METHYL-1H-PYRAZOL-5-YL)-2-OXO-1-(3-(TRIFLUOROMETHYL)PHENYL)-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE

Systematic Name

English

AZD-9668

Code

English

Alvelestat [WHO-DD]

Common Name

English

3-PYRIDINECARBOXAMIDE, 1,2-DIHYDRO-6-METHYL-5-(1-METHYL-1H-PYRAZOL-5-YL)-N-((5-(METHYLSULFONYL)-2-PYRIDINYL)METHYL)-2-OXO-1-(3-(TRIFLUOROMETHYL)PHENYL)-

Systematic Name

English

AZD9668

Code

English

alvelestat [INN]

Common Name

English

MPH-966

Code

English

MPH966

Code

English

6-METHYL-5-(1-METHYL-1H-PYRAZOL-5-YL)-N-((5-(METHYLSULFONYL)PYRIDIN-2-YL)METHYL)-2-OXO-1-(3-(TRIFLUOROMETHYL)PHENYL)-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C783