PYRROLE-2-CARBONITRILE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H4N2
Molecular Weight	92.0987
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PYRROLE-2-CARBONITRILE

Structure Search

SMILES

N#CC1=CC=CN1

InChI

InChIKey=BQMPGKPTOHKYHS-UHFFFAOYSA-N

InChI=1S/C5H4N2/c6-4-5-2-1-3-7-5/h1-3,7H

HIDE SMILES / InChI

Molecular Formula	C5H4N2
Molecular Weight	92.0987
Charge	0
Count

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

Approval Year

PubMed

PubMed

Title	Date	PubMed
Photochemical isomerization reactions of cyanopyrroles: a theoretical study.	2006-11-23	17107117
SAR studies of 6-aryl-1,3-dihydrobenzimidazol-2-ones as progesterone receptor antagonists.	2005-08-01	15978807

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:03:29 GMT 2025` Edited by `admin` on `Mon Mar 31 20:03:29 GMT 2025`
Record UNII	6D25BMC1PP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-CYANOPYRROLE

Preferred Name

English

PYRROLE-2-CARBONITRILE

Systematic Name

English

NSC-106054

Code

English

Code System Code Type Description

EPA CompTox

DTXSID30196400

Created by admin on Mon Mar 31 20:03:29 GMT 2025 , Edited by admin on Mon Mar 31 20:03:29 GMT 2025

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NSC

106054

Created by admin on Mon Mar 31 20:03:29 GMT 2025 , Edited by admin on Mon Mar 31 20:03:29 GMT 2025

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CAS

4513-94-4

Created by admin on Mon Mar 31 20:03:29 GMT 2025 , Edited by admin on Mon Mar 31 20:03:29 GMT 2025

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FDA UNII

6D25BMC1PP

Created by admin on Mon Mar 31 20:03:29 GMT 2025 , Edited by admin on Mon Mar 31 20:03:29 GMT 2025

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PUBCHEM

138277

Created by admin on Mon Mar 31 20:03:29 GMT 2025 , Edited by admin on Mon Mar 31 20:03:29 GMT 2025

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