5-((3-METHYL-1,1-DIOXIDO-4-THIOMORPHOLINYL)IMINO)-4-OXO-PENTANENITRILE

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H15N3O3S
Molecular Weight	257.309
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 5-((3-METHYL-1,1-DIOXIDO-4-THIOMORPHOLINYL)IMINO)-4-OXO-PENTANENITRILE

Structure Search

SMILES

CC1CS(=O)(=O)CCN1\N=C\C(=O)CCC#N

InChI

InChIKey=AZOCTOVKERTEJT-KPKJPENVSA-N

InChI=1S/C10H15N3O3S/c1-9-8-17(15,16)6-5-13(9)12-7-10(14)3-2-4-11/h7,9H,2-3,5-6,8H2,1H3/b12-7+

HIDE SMILES / InChI

Molecular Formula	C10H15N3O3S
Molecular Weight	257.309
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:26:36 UTC 2023` Edited by `admin` on `Sat Dec 16 17:26:36 UTC 2023`
Record UNII	UGA3SKR23V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-((3-METHYL-1,1-DIOXIDO-4-THIOMORPHOLINYL)IMINO)-4-OXO-PENTANENITRILE

Systematic Name

English

NIFURTIMOX METABOLITE M-1

Common Name

English

PENTANENITRILE, 5-((3-METHYL-1,1-DIOXIDO-4-THIOMORPHOLINYL)IMINO)-4-OXO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

156596394

Created by admin on Sat Dec 16 17:26:36 UTC 2023 , Edited by admin on Sat Dec 16 17:26:36 UTC 2023

PRIMARY

FDA UNII

UGA3SKR23V

Created by admin on Sat Dec 16 17:26:36 UTC 2023 , Edited by admin on Sat Dec 16 17:26:36 UTC 2023

PRIMARY

CAS

1378233-39-6

Created by admin on Sat Dec 16 17:26:36 UTC 2023 , Edited by admin on Sat Dec 16 17:26:36 UTC 2023

PRIMARY

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Name	Property Type	Parameters
Biological Half-life	PHARMACOKINETIC	SINGLE DOSE

Tmax	PHARMACOKINETIC	SINGLE DOSE