4-BUTYL-5-IMINO-1,2,4-TRIAZOLIDINE-3-THIONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H12N4S
Molecular Weight	172.251
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-BUTYL-5-IMINO-1,2,4-TRIAZOLIDINE-3-THIONE

Structure Search

SMILES

CCCCN1C(=N)NNC1=S

InChI

InChIKey=YVYGAERHPMSKME-UHFFFAOYSA-N

InChI=1S/C6H12N4S/c1-2-3-4-10-5(7)8-9-6(10)11/h2-4H2,1H3,(H2,7,8)(H,9,11)

HIDE SMILES / InChI

Molecular Formula	C6H12N4S
Molecular Weight	172.251
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 19:44:24 GMT 2025` Edited by `admin` on `Tue Apr 01 19:44:24 GMT 2025`
Record UNII	26Y8F2FGA0
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-207835

Preferred Name

English

4-BUTYL-5-IMINO-1,2,4-TRIAZOLIDINE-3-THIONE

Systematic Name

English

3H-1,2,4-TRIAZOLE-3-THIONE, 5-AMINO-4-BUTYL-2,4-DIHYDRO-

Systematic Name

English

4H-1,2,4-TRIAZOLE-3-THIOL, 5-AMINO-4-BUTYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

26Y8F2FGA0

Created by admin on Tue Apr 01 19:44:24 GMT 2025 , Edited by admin on Tue Apr 01 19:44:24 GMT 2025

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EPA CompTox

DTXSID30217003

Created by admin on Tue Apr 01 19:44:24 GMT 2025 , Edited by admin on Tue Apr 01 19:44:24 GMT 2025

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PUBCHEM

3003877

Created by admin on Tue Apr 01 19:44:24 GMT 2025 , Edited by admin on Tue Apr 01 19:44:24 GMT 2025

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NSC

207835

Created by admin on Tue Apr 01 19:44:24 GMT 2025 , Edited by admin on Tue Apr 01 19:44:24 GMT 2025

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CAS

66870-10-8

Created by admin on Tue Apr 01 19:44:24 GMT 2025 , Edited by admin on Tue Apr 01 19:44:24 GMT 2025

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