5-(MESITYLDITHIO)-1-PHENYL-1H-TETRAAZOLE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H16N4S2
Molecular Weight	328.455
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-(MESITYLDITHIO)-1-PHENYL-1H-TETRAAZOLE

Structure Search

SMILES

CC1=CC(C)=C(SSC2=NN=NN2C3=CC=CC=C3)C(C)=C1

InChI

InChIKey=JGTXTOWSOSIGCT-UHFFFAOYSA-N

InChI=1S/C16H16N4S2/c1-11-9-12(2)15(13(3)10-11)21-22-16-17-18-19-20(16)14-7-5-4-6-8-14/h4-10H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C16H16N4S2
Molecular Weight	328.455
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 19:52:37 GMT 2025` Edited by `admin` on `Tue Apr 01 19:52:37 GMT 2025`
Record UNII	3D2SQ2T3PN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-297589

Preferred Name

English

5-(MESITYLDITHIO)-1-PHENYL-1H-TETRAAZOLE

Systematic Name

English

1-PHENYL-5-((2,4,6-TRIMETHYLPHENYL)DITHIO)-1H-TETRAZOLE

Systematic Name

English

1H-TETRAZOLE, 1-PHENYL-5-((2,4,6-TRIMETHYLPHENYL)DITHIO)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

326374

Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025

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FDA UNII

3D2SQ2T3PN

Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025

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CAS

52065-84-6

Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025

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NSC

297589

Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025

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EPA CompTox

DTXSID00200043

Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025

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