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Substance Name: 2-Propenoic acid, 3-((2,6-dimethoxy-4-pyrimidinyl)amino)-2-(((2-methylphenyl)amino)carbonyl)-,ethyl ester, (E)-
RN: 172753-11-6
InChIKey: QNBGOQCOZTVBTD-ACCUITESSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N4-O5

Molecular Weight

  • 386.4058
 
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Names and Synonyms

  • 2-Propenoic acid, 3-((2,6-dimethoxy-4-pyrimidinyl)amino)-2-(((2-methylphenyl)amino)carbonyl)-,ethyl ester, (E)-

Registry Numbers

CAS Registry Number

  • 172753-11-6

System Generated Number

  • 0172753116

Structure Descriptors

InChI

1S/C19H22N4O5/c1-5-28-18(25)13(17(24)21-14-9-7-6-8-12(14)2)11-20-15-10-16(26-3)23-19(22-15)27-4/h6-11H,5H2,1-4H3,(H,21,24)(H,20,22,23)/b13-11+

InChIKey

QNBGOQCOZTVBTD-ACCUITESSA-N

Smiles

CCOC(=O)/C(=C/Nc1cc(nc(n1)OC)OC)/C(=O)Nc2ccccc2C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal > 800mg/kg (800mg/kg)   Pharmaceutical Chemistry Journal Vol. 29, Pg. 339, 1995.