4-((4-CHLOROBENZYL)THIO)CINNOLINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H11ClN2S
Molecular Weight	286.779
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-((4-CHLOROBENZYL)THIO)CINNOLINE

Structure Search

SMILES

ClC1=CC=C(CSC2=C3C=CC=CC3=NN=C2)C=C1

InChI

InChIKey=FSGKLUMXHXGGCK-UHFFFAOYSA-N

InChI=1S/C15H11ClN2S/c16-12-7-5-11(6-8-12)10-19-15-9-17-18-14-4-2-1-3-13(14)15/h1-9H,10H2

HIDE SMILES / InChI

Molecular Formula	C15H11ClN2S
Molecular Weight	286.779
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 `Sat Dec 16 13:07:05 GMT 2023` Edited by `admin` on `Sat Dec 16 13:07:05 GMT 2023`
Record UNII	PKW4796W3U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-((4-CHLOROBENZYL)THIO)CINNOLINE

Systematic Name

English

4-(((4-CHLOROPHENYL)METHYL)THIO)CINNOLINE

Systematic Name

English

CINNOLINE, 4-(((4-CHLOROPHENYL)METHYL)THIO)-

Systematic Name

English

CINNOLINE, 4-((P-CHLOROBENZYL)THIO)-

Systematic Name

English

NSC-66097

Code

English

Code System Code Type Description

FDA UNII

PKW4796W3U

Created by admin on Sat Dec 16 13:07:05 GMT 2023 , Edited by admin on Sat Dec 16 13:07:05 GMT 2023

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EPA CompTox

DTXSID60219853

Created by admin on Sat Dec 16 13:07:05 GMT 2023 , Edited by admin on Sat Dec 16 13:07:05 GMT 2023

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CAS

6959-27-9

Created by admin on Sat Dec 16 13:07:05 GMT 2023 , Edited by admin on Sat Dec 16 13:07:05 GMT 2023

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NSC

66097

Created by admin on Sat Dec 16 13:07:05 GMT 2023 , Edited by admin on Sat Dec 16 13:07:05 GMT 2023

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PUBCHEM

248694

Created by admin on Sat Dec 16 13:07:05 GMT 2023 , Edited by admin on Sat Dec 16 13:07:05 GMT 2023

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