DMS-612

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National Institutes of Health Divider Arrow

NCATS

Investigational

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H21NO7S2
Molecular Weight	379.449
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DMS-612

Structure Search

SMILES

CC1=C(C=O)C=CC(=C1)N(CCOS(C)(=O)=O)CCOS(C)(=O)=O

InChI

InChIKey=CQVKMVQRSNNAGO-UHFFFAOYSA-N

InChI=1S/C14H21NO7S2/c1-12-10-14(5-4-13(12)11-16)15(6-8-21-23(2,17)18)7-9-22-24(3,19)20/h4-5,10-11H,6-9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C14H21NO7S2
Molecular Weight	379.449
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

PubMed

Title	Date	PubMed
Degradation of NSC-281612 (4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-2-methyl-benzaldehyde), an experimental antineoplastic agent: effects of pH, solvent composition, (SBE)7m-beta-CD, and HP-beta-CD on stability.	2004-03	14762892

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:37:59 GMT 2025` Edited by `admin` on `Mon Mar 31 18:37:59 GMT 2025`
Record UNII	96B0BRI1JU
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DMS-612

Common Name

English

BENZALDEHYDE, 4-(BIS(2-((METHYLSULFONYL)OXY)ETHYL)AMINO)-2-METHYL-

Preferred Name

English

NSC-281612

Code

English

Code System Code Type Description

EPA CompTox

DTXSID60205539

Created by admin on Mon Mar 31 18:37:59 GMT 2025 , Edited by admin on Mon Mar 31 18:37:59 GMT 2025

PRIMARY

CAS

56967-08-9

Created by admin on Mon Mar 31 18:37:59 GMT 2025 , Edited by admin on Mon Mar 31 18:37:59 GMT 2025

PRIMARY

NCI_THESAURUS

C107164

Created by admin on Mon Mar 31 18:37:59 GMT 2025 , Edited by admin on Mon Mar 31 18:37:59 GMT 2025

PRIMARY

FDA UNII

96B0BRI1JU

Created by admin on Mon Mar 31 18:37:59 GMT 2025 , Edited by admin on Mon Mar 31 18:37:59 GMT 2025

PRIMARY

PUBCHEM

322931

Created by admin on Mon Mar 31 18:37:59 GMT 2025 , Edited by admin on Mon Mar 31 18:37:59 GMT 2025

PRIMARY

NSC

281612

Created by admin on Mon Mar 31 18:37:59 GMT 2025 , Edited by admin on Mon Mar 31 18:37:59 GMT 2025

PRIMARY

Related Record Type Details


					96B0BRI1JU

DMS-612

ACTIVE MOIETY