VERUBECESTAT

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H17F2N5O3S
Molecular Weight	409.41
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of VERUBECESTAT

Structure Search

SMILES

CN1C(N)=N[C@@](C)(CS1(=O)=O)C2=CC(NC(=O)C3=CC=C(F)C=N3)=CC=C2F

InChI

InChIKey=YHYKUSGACIYRML-KRWDZBQOSA-N

InChI=1S/C17H17F2N5O3S/c1-17(9-28(26,27)24(2)16(20)23-17)12-7-11(4-5-13(12)19)22-15(25)14-6-3-10(18)8-21-14/h3-8H,9H2,1-2H3,(H2,20,23)(H,22,25)/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C17H17F2N5O3S
Molecular Weight	409.41
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 `Sat Dec 16 11:24:31 UTC 2023` Edited by `admin` on `Sat Dec 16 11:24:31 UTC 2023`
Record UNII	J1I0P6WT7T
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

VERUBECESTAT

Official Name

English

VERUBECESTAT [USAN]

Common Name

English

VERUBECESTAT [JAN]

Common Name

English

verubecestat [INN]

Common Name

English

SCH-900931

Code

English

SCH900931

Code

English

2-PYRIDINECARBOXAMIDE, N-(3-((5R)-3-AMINO-5,6-DIHYDRO-2,5-DIMETHYL-1,1-DIOXIDO-2H-1,2,4-THIADIAZIN-5-YL)-4-FLUOROPHENYL)-5-FLUORO-

Systematic Name

English

Verubecestat [WHO-DD]

Common Name

English

SCH 900931

Code

English

MK-8931

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C471

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

NCI_THESAURUS

C1509

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

Code System Code Type Description

NCI_THESAURUS

C152868

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

EVMPD

SUB185177

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

CAS

1286770-55-5

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

SMS_ID

100000170947

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

FDA UNII

J1I0P6WT7T

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

WIKIPEDIA

Verubecestat

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

EPA CompTox

DTXSID30102062

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

PUBCHEM

51352361

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

ChEMBL

CHEMBL3301601

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

INN

10028

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

CAS

1613380-81-6

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

SUPERSEDED

USAN

BC-75

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

DRUG BANK

DB12285

Created by admin on Sat Dec 16 11:24:32 UTC 2023 , Edited by admin on Sat Dec 16 11:24:32 UTC 2023

PRIMARY

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