SQ-11447

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H21N3OS
Molecular Weight	267.39
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CNC(=O)NC1=C(SCCCN(C)C)C=CC=C1

InChI

InChIKey=LNAUGIJFFGNNRW-UHFFFAOYSA-N

InChI=1S/C13H21N3OS/c1-14-13(17)15-11-7-4-5-8-12(11)18-10-6-9-16(2)3/h4-5,7-8H,6,9-10H2,1-3H3,(H2,14,15,17)

HIDE SMILES / InChI

Molecular Formula	C13H21N3OS
Molecular Weight	267.39
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 13:45:41 GMT 2023` Edited by `admin` on `Sat Dec 16 13:45:41 GMT 2023`
Record UNII	N0I2MQ814W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SQ-11447

Code

English

1-(O-((3-DIMETHYLAMINOPROPYL)THIO)PHENYL)-3-METHYL UREA

Systematic Name

English

UREA, N-(2-((3-(DIMETHYLAMINO)PROPYL)THIO)PHENYL)-N'-METHYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

N0I2MQ814W

Created by admin on Sat Dec 16 13:45:42 GMT 2023 , Edited by admin on Sat Dec 16 13:45:42 GMT 2023

PRIMARY

CAS

33406-68-7

Created by admin on Sat Dec 16 13:45:42 GMT 2023 , Edited by admin on Sat Dec 16 13:45:42 GMT 2023

PRIMARY

PUBCHEM

193155

Created by admin on Sat Dec 16 13:45:42 GMT 2023 , Edited by admin on Sat Dec 16 13:45:42 GMT 2023

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EPA CompTox

DTXSID50187052

Created by admin on Sat Dec 16 13:45:42 GMT 2023 , Edited by admin on Sat Dec 16 13:45:42 GMT 2023

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SQ-11447 TOSYLATE

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SQ-11447 C-14

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