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Substance Name: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl-5-nitroso-, 4-((1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)methyl)hydrazone
RN: 113597-38-9
InChIKey: XIKDCNZFUZNDHC-IFNZCMHPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H17-N7-O4

Molecular Weight

  • 383.3663
 
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Names and Synonyms

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl-5-nitroso-, 4-((1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)methyl)hydrazone

Registry Numbers

CAS Registry Number

  • 113597-38-9

System Generated Number

  • 0113597389

Structure Descriptors

InChI

1S/C17H17N7O4/c1-10-12(15(25)24(20-10)11-7-5-4-6-8-11)9-18-19-14-13(21-28)16(26)23(3)17(27)22(14)2/h4-9,13,18H,1-3H3/b12-9-,19-14+

InChIKey

XIKDCNZFUZNDHC-IFNZCMHPSA-N

Smiles

CC\1=NN(C(=O)/C1=C\N/N=C/2\C(C(=O)N(C(=O)N2C)C)N=O)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 800mg/kg (800mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 860, 1987.