4-((4-CHLOROBENZYL)THIO)-2-PHENYL-5-(1-PIPERIDINYL)-3(2H)-PYRIDAZINONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H22ClN3OS
Molecular Weight	411.948
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-((4-CHLOROBENZYL)THIO)-2-PHENYL-5-(1-PIPERIDINYL)-3(2H)-PYRIDAZINONE

Structure Search

SMILES

ClC1=CC=C(CSC2=C(C=NN(C2=O)C3=CC=CC=C3)N4CCCCC4)C=C1

InChI

InChIKey=AMTDPCMPXBJWNL-UHFFFAOYSA-N

InChI=1S/C22H22ClN3OS/c23-18-11-9-17(10-12-18)16-28-21-20(25-13-5-2-6-14-25)15-24-26(22(21)27)19-7-3-1-4-8-19/h1,3-4,7-12,15H,2,5-6,13-14,16H2

HIDE SMILES / InChI

Molecular Formula	C22H22ClN3OS
Molecular Weight	411.948
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 `Tue Apr 01 20:04:04 GMT 2025` Edited by `admin` on `Tue Apr 01 20:04:04 GMT 2025`
Record UNII	VR7FC8U8E8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-((4-CHLOROBENZYL)THIO)-2-PHENYL-5-(1-PIPERIDINYL)-3(2H)-PYRIDAZINONE

Systematic Name

English

NSC-66130

Preferred Name

English

Code System Code Type Description

CAS

5785-97-7

Created by admin on Tue Apr 01 20:04:04 GMT 2025 , Edited by admin on Tue Apr 01 20:04:04 GMT 2025

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EPA CompTox

DTXSID40206564

Created by admin on Tue Apr 01 20:04:04 GMT 2025 , Edited by admin on Tue Apr 01 20:04:04 GMT 2025

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FDA UNII

VR7FC8U8E8

Created by admin on Tue Apr 01 20:04:04 GMT 2025 , Edited by admin on Tue Apr 01 20:04:04 GMT 2025

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PUBCHEM

248727

Created by admin on Tue Apr 01 20:04:04 GMT 2025 , Edited by admin on Tue Apr 01 20:04:04 GMT 2025

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NSC

66130

Created by admin on Tue Apr 01 20:04:04 GMT 2025 , Edited by admin on Tue Apr 01 20:04:04 GMT 2025

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