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Substance Name: Carbonimidic dihydrazide, bis(2-(hexahydro-2,4,6-trioxo-5-(2-propenyl)-5-pyrimidinyl)-1-methylethylidene)-
RN: 37175-94-3
InChIKey: RYTRCCAJIGDJOI-NXMZODBASA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N9-O6

Molecular Weight

  • 501.501
 
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Names and Synonyms

Synonyms

  • 5-Acetonyl-5-allylbarbituric acid 5,5'-imidocarbonyldihydrazone
  • Barbituric acid, 5-acetonyl-5-allyl-, 5,5'-imidocarbonyldihydrazone
  • N,N'-Bis(5-allyl-5-propylidenebarbituryl)diaminoguanidine

Systematic Name

  • Carbonimidic dihydrazide, bis(2-(hexahydro-2,4,6-trioxo-5-(2-propenyl)-5-pyrimidinyl)-1-methylethylidene)-

Registry Numbers

CAS Registry Number

  • 37175-94-3

System Generated Number

  • 0037175943

Structure Descriptors

InChI

1S/C21H27N9O6/c1-5-7-20(13(31)23-18(35)24-14(20)32)9-11(3)27-29-17(22)30-28-12(4)10-21(8-6-2)15(33)25-19(36)26-16(21)34/h5-6H,1-2,7-10H2,3-4H3,(H3,22,29,30)(H2,23,24,31,32,35)(H2,25,26,33,34,36)/b27-11+,28-12+

InChIKey

RYTRCCAJIGDJOI-NXMZODBASA-N

Smiles

C1(C(NC(=O)NC1=O)=O)(C\C(=N\NC(N\N=C(\CC1(C(NC(=O)NC1=O)=O)CC=C)C)=N)C)CC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 906mg/kg (906mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Archivum Immunologiae et Therapiae Experimentalis. Vol. 20, Pg. 385, 1972.