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Substance Name: N,N'-Bis(2-(((5-((dimethylamino)methyl)furan-2-yl)methyl)sulfanyl)ethyl)-2-nitroethene-1,1-diamine
RN: 72126-78-4
UNII: F01WAX6X3P
InChIKey: VTVSRHZKBPARSF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H35-N5-O4-S2

Molecular Weight

  • 497.6815
 
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Names and Synonyms

Name of Substance

  • N,N'-Bis(2-(((5-((dimethylamino)methyl)furan-2-yl)methyl)sulfanyl)ethyl)-2-nitroethene-1,1-diamine

Synonyms

  • BRN 5365805
  • N,N'-Bis(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-2-nitro-1,1-ethenediamine
  • UNII-F01WAX6X3P

Systematic Name

  • 1,1-Ethenediamine, N,N'-bis(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-2-nitro-

Registry Numbers

CAS Registry Number

  • 72126-78-4

FDA UNII

  • F01WAX6X3P

System Generated Number

  • 0072126784

Structure Descriptors

InChI

1S/C22H35N5O4S2/c1-25(2)13-18-5-7-20(30-18)16-32-11-9-23-22(15-27(28)29)24-10-12-33-17-21-8-6-19(31-21)14-26(3)4/h5-8,15,23-24H,9-14,16-17H2,1-4H3

InChIKey

VTVSRHZKBPARSF-UHFFFAOYSA-N

Smiles

CN(C)Cc1ccc(o1)CSCCNC(=C[N+](=O)[O-])NCCSCc2ccc(o2)CN(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 5mg/kg (5mg/kg)   Journal of Medicinal Chemistry. Vol. 35, Pg. 1102, 1992.