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Substance Name: Ketone, 3-indolyl methyl, azine
RN: 101831-61-2
InChIKey: MYFIGWQIMQGENQ-RNIAWFEPSA-N

Molecular Formula

  • C20-H18-N4

Molecular Weight

  • 314.39
 
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Names and Synonyms

Synonyms

  • 3-Indolyl-methyl ketazine
  • 4-21-00-03776 (Beilstein Handbook Reference)
  • BRN 0306158

Systematic Name

  • Ketone, 3-indolyl methyl, azine

Registry Numbers

CAS Registry Number

  • 101831-61-2

System Generated Number

  • 0101831612

Structure Descriptors

InChI

1S/C20H18N4/c1-13(17-11-21-19-9-5-3-7-15(17)19)23-24-14(2)18-12-22-20-10-6-4-8-16(18)20/h3-12,21-22H,1-2H3/b23-13+,24-14+

InChIKey

MYFIGWQIMQGENQ-RNIAWFEPSA-N

Smiles

c12c(c[nH]c1cccc2)\C(=N\N=C(\c1c2c(cccc2)[nH]c1)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 4470ug/kg (4.47mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12114,