NELEZAPRINE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H21ClN2
Molecular Weight	300.826
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of NELEZAPRINE

Structure Search

SMILES

CN(C)CC\C=C1\C2=CC=CN2CCC3=CC=C(Cl)C=C13

InChI

InChIKey=HOVKCSFHZRYZBX-FZSIALSZSA-N

InChI=1S/C18H21ClN2/c1-20(2)10-3-5-16-17-13-15(19)8-7-14(17)9-12-21-11-4-6-18(16)21/h4-8,11,13H,3,9-10,12H2,1-2H3/b16-5+

HIDE SMILES / InChI

Molecular Formula	C18H21ClN2
Molecular Weight	300.826
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Description
Sources: https://books.google.ru/books?id=xUlaDwAAQBAJ&pg=PT1535&lpg=PT1535&dq=NELEZAPRINE retrieved from Drugs: Synonyms and Properties: Synonyms and Properties edited by George W.A Milne | https://www.kegg.jp/dbget-bin/www_bget?dr:D05135

Nelezaprine is a skeletal muscle relaxant.

Originator

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:28:02 UTC 2023` Edited by `admin` on `Fri Dec 15 16:28:02 UTC 2023`
Record UNII	OC19J8O751
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NELEZAPRINE

Official Name

English

nelezaprine [INN]

Common Name

English

(E)-9-CHLORO-11-(3-(DIMETHYLAMINO)PROPYLIDENE)-6,11-DIHYDRO-5H-PYRROLO(2,1-B)(3)BENZAZEPINE

Systematic Name

English

1-PROPANAMINE, 3-(9-CHLORO-5,6-DIHYDRO-11H-PYRROLO(2,1-B)(3)BENZAZEPIN-11-YLIDENE)-N,N-DIMETHYL-, (E)-, (Z)-2-

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29696

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

Code System Code Type Description

EVMPD

SUB09185MIG

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

PRIMARY

PUBCHEM

6436130

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

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NCI_THESAURUS

C90893

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

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INN

6291

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

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EPA CompTox

DTXSID60989726

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

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SMS_ID

100000084149

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

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FDA UNII

OC19J8O751

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

PRIMARY

ChEMBL

CHEMBL2110942

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

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CAS

69624-60-8

Created by admin on Fri Dec 15 16:28:02 UTC 2023 , Edited by admin on Fri Dec 15 16:28:02 UTC 2023

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Related Record Type Details


					3Q9L107XJB

NELEZAPRINE MALEATE

SALT/SOLVATE -> PARENT

Related Record Type Details


					OC19J8O751

ACTIVE MOIETY