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Substance Name: Pyrrolidine, 1-((4-(5-ethyl-5-phenyltetrahydro-2,4,6-trioxo-1(2H)-pyrimidinyl)-1-piperazinyl)acetyl)-
RN: 42445-87-4
InChIKey: JAGNSNKJJQNAAU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-N5-O4

Molecular Weight

  • 427.5021
 
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Names and Synonyms

Synonym

  • Barbituric acid, 5-ethyl-5-phenyl-1-(4-((1-pyrroldinylcarbonyl)methyl)-1-piperzinyl)-

Systematic Name

  • Pyrrolidine, 1-((4-(5-ethyl-5-phenyltetrahydro-2,4,6-trioxo-1(2H)-pyrimidinyl)-1-piperazinyl)acetyl)-

Registry Numbers

CAS Registry Number

  • 42445-87-4

System Generated Number

  • 0042445874

Structure Descriptors

InChI

1S/C22H29N5O4/c1-2-22(17-8-4-3-5-9-17)19(29)23-21(31)27(20(22)30)26-14-12-24(13-15-26)16-18(28)25-10-6-7-11-25/h3-5,8-9H,2,6-7,10-16H2,1H3,(H,23,29,31)

InChIKey

JAGNSNKJJQNAAU-UHFFFAOYSA-N

Smiles

CCC1(C(=O)NC(=O)N(C1=O)N2CCN(CC2)CC(=O)N3CCCC3)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1400mg/kg (1400mg/kg)   French Demande Patent Document. Vol. #2152441,