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Substance Name: 2-Propenenitrile, 3-amino-2-((1,3-dihydro-3-oxo-2H-indol-2-ylidene)methyl)-3-(4-methyl-1-Piperazinyl)-
RN: 171853-07-9
InChIKey: ABNBECZHIQVPGK-ADHCAXNZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N5-O

Molecular Weight

  • 309.3711
 
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Names and Synonyms

  • 2-Propenenitrile, 3-amino-2-((1,3-dihydro-3-oxo-2H-indol-2-ylidene)methyl)-3-(4-methyl-1-Piperazinyl)-

Registry Numbers

CAS Registry Number

  • 171853-07-9

System Generated Number

  • 0171853079

Structure Descriptors

InChI

1S/C17H19N5O/c1-21-6-8-22(9-7-21)17(19)12(11-18)10-15-16(23)13-4-2-3-5-14(13)20-15/h2-5,10,20H,6-9,19H2,1H3/b15-10-,17-12+

InChIKey

ABNBECZHIQVPGK-ADHCAXNZSA-N

Smiles

CN1CCN(CC1)/C(=C(\C=C/2\C(=O)c3ccccc3N2)/C#N)/N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 29, Pg. 610, 1995.