S-(1-METHYL-1H-TETRAZOL-5-YL) 4-METHYLBENZENESULFONOTHIOATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H10N4O2S2
Molecular Weight	270.331
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of S-(1-METHYL-1H-TETRAZOL-5-YL) 4-METHYLBENZENESULFONOTHIOATE

Structure Search

SMILES

CN1N=NN=C1SS(=O)(=O)C2=CC=C(C)C=C2

InChI

InChIKey=HKWRBJZYIKUKHX-UHFFFAOYSA-N

InChI=1S/C9H10N4O2S2/c1-7-3-5-8(6-4-7)17(14,15)16-9-10-11-12-13(9)2/h3-6H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H10N4O2S2
Molecular Weight	270.331
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 12:45:58 GMT 2023` Edited by `admin` on `Sat Dec 16 12:45:58 GMT 2023`
Record UNII	7KN5XV3HFA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

S-(1-METHYL-1H-TETRAZOL-5-YL) 4-METHYLBENZENESULFONOTHIOATE

Systematic Name

English

1-METHYL-5-(4-METHYLPHENYL)SULFONYLSULFANYL-TETRAZOLE

Systematic Name

English

NSC-297593

Code

English

Code System Code Type Description

CAS

51618-45-2

Created by admin on Sat Dec 16 12:45:58 GMT 2023 , Edited by admin on Sat Dec 16 12:45:58 GMT 2023

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PUBCHEM

326378

Created by admin on Sat Dec 16 12:45:58 GMT 2023 , Edited by admin on Sat Dec 16 12:45:58 GMT 2023

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FDA UNII

7KN5XV3HFA

Created by admin on Sat Dec 16 12:45:58 GMT 2023 , Edited by admin on Sat Dec 16 12:45:58 GMT 2023

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NSC

297593

Created by admin on Sat Dec 16 12:45:58 GMT 2023 , Edited by admin on Sat Dec 16 12:45:58 GMT 2023

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EPA CompTox

DTXSID40199563

Created by admin on Sat Dec 16 12:45:58 GMT 2023 , Edited by admin on Sat Dec 16 12:45:58 GMT 2023

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