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Substance Name: 4-Thiomorpholinecarboxamide, N-(2-(bis(2-chloroethyl)amino)tetrahydro-2H-1,3,2-oxazaphosphorin-4-yl)-N-hydroxy-, P-oxide
RN: 97139-48-5
InChIKey: QQIKNSRTSSXTMO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H23-Cl2-N4-O4-P-S

Molecular Weight

  • 421.2837
 
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Names and Synonyms

  • 4-Thiomorpholinecarboxamide, N-(2-(bis(2-chloroethyl)amino)tetrahydro-2H-1,3,2-oxazaphosphorin-4-yl)-N-hydroxy-, P-oxide

Registry Numbers

CAS Registry Number

  • 97139-48-5

System Generated Number

  • 0097139485

Structure Descriptors

InChI

1S/C12H23Cl2N4O4PS/c13-2-4-17(5-3-14)23(21)15-11(1-8-22-23)18(20)12(19)16-6-9-24-10-7-16/h11,20H,1-10H2,(H,15,21)

InChIKey

QQIKNSRTSSXTMO-UHFFFAOYSA-N

Smiles

ON(C1CCOP(=O)(N1)N(CCCl)CCCl)C(=O)N2CCSCC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4618692,