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Substance Name: Propanedioic acid, (4-(((diethylamino)acetyl)oxy)-1,3-dithiolan-2-ylidene)-, diethyl ester
RN: 62052-54-4
InChIKey: CFXUXJZFZJNLQZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H25-N-O6-S2

Molecular Weight

  • 391.5065
 
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Names and Synonyms

Synonym

  • Diethyl (4-(((diethylamino)acetyl)oxy)-1,3-dithiolan-2-ylidene)propanedioate

Systematic Name

  • Propanedioic acid, (4-(((diethylamino)acetyl)oxy)-1,3-dithiolan-2-ylidene)-, diethyl ester

Registry Numbers

CAS Registry Number

  • 62052-54-4

System Generated Number

  • 0062052544

Structure Descriptors

InChI

1S/C16H25NO6S2/c1-5-17(6-2)9-11(18)23-12-10-24-16(25-12)13(14(19)21-7-3)15(20)22-8-4/h12H,5-10H2,1-4H3

InChIKey

CFXUXJZFZJNLQZ-UHFFFAOYSA-N

Smiles

CCN(CC)CC(=O)OC1CSC(=C(C(=O)OCC)C(=O)OCC)S1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4112089,