Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Thiomorpholine, 4-(4-((2-(2,4-dichlorophenyl)-2-(4H-1,2,4-triazol-4-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)-, 1,1-dioxide, cis-
RN: 103661-12-7
InChIKey: OCRCZGFSYGUQPJ-NFBKMPQASA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H24-Cl2-N4-O5-S

Molecular Weight

  • 539.4376
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Thiomorpholine, 4-(4-((2-(2,4-dichlorophenyl)-2-(4H-1,2,4-triazol-4-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)-, 1,1-dioxide, cis-

Registry Numbers

CAS Registry Number

  • 103661-12-7

System Generated Number

  • 0103661127

Structure Descriptors

InChI

1S/C23H24Cl2N4O5S/c24-17-1-6-21(22(25)11-17)23(14-28-15-26-27-16-28)33-13-20(34-23)12-32-19-4-2-18(3-5-19)29-7-9-35(30,31)10-8-29/h1-6,11,15-16,20H,7-10,12-14H2/t20-,23-/m1/s1

InChIKey

OCRCZGFSYGUQPJ-NFBKMPQASA-N

Smiles

c1cc(ccc1N2CCS(=O)(=O)CC2)OC[C@@H]3CO[C@@](O3)(Cn4cnnc4)c5ccc(cc5Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 4gm/kg (4000mg/kg)   United States Patent Document. Vol. #4640918,