BEPAFANT

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C23H22ClN5O2S
Molecular Weight	467.971
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BEPAFANT

Structure Search

SMILES

CC1=NN=C2CN=C(C3=C(SC4=C3CC(C4)C(=O)N5CCOCC5)N12)C6=CC=CC=C6Cl

InChI

InChIKey=FWYVRZOREBYLCY-UHFFFAOYSA-N

InChI=1S/C23H22ClN5O2S/c1-13-26-27-19-12-25-21(15-4-2-3-5-17(15)24)20-16-10-14(11-18(16)32-23(20)29(13)19)22(30)28-6-8-31-9-7-28/h2-5,14H,6-12H2,1H3

HIDE SMILES / InChI

Molecular Formula	C23H22ClN5O2S
Molecular Weight	467.971
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:06:38 UTC 2023` Edited by `admin` on `Fri Dec 15 16:06:38 UTC 2023`
Record UNII	CKS724B66O
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BEPAFANT

Official Name

English

BEPAFANT [MART.]

Common Name

English

bepafant [INN]

Common Name

English

WEB-2170

Code

English

4-((6-(O-CHLOROPHENYL)-8,9-DIHYDRO-1-METHYL-4H,7H-CYCLOPENTA(4,5)THIENO(3,2-F)-S-TRIAZOLO(4,3-A)(1,4)DIAZEPIN-8-YL)CARBONYL)MORPHOLINE

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1327

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

Code System Code Type Description

NCI_THESAURUS

C77947

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

ChEMBL

CHEMBL325439

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

PUBCHEM

65923

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

MESH

C063964

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

INN

6366

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

SMS_ID

100000086066

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

CAS

114776-28-2

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

FDA UNII

CKS724B66O

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

EVMPD

SUB05774MIG

Created by admin on Fri Dec 15 16:06:38 UTC 2023 , Edited by admin on Fri Dec 15 16:06:38 UTC 2023

PRIMARY

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