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Substance Name: 1H-Imidazole-1-carbothioic acid, 4,5-dihydro-2-(2-((2-methylphenyl)amino)ethyl)-5-oxo-4-(phenylmethylene)-, ((4-(dimethylamino)phenyl)methylene)hydrazide
RN: 109901-84-0
InChIKey: HRTLUAMWWYQTEY-DVIYFVMSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H30-N6-O-S

Molecular Weight

  • 510.663
 
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Names and Synonyms

  • 1H-Imidazole-1-carbothioic acid, 4,5-dihydro-2-(2-((2-methylphenyl)amino)ethyl)-5-oxo-4-(phenylmethylene)-, ((4-(dimethylamino)phenyl)methylene)hydrazide

Registry Numbers

CAS Registry Number

  • 109901-84-0

System Generated Number

  • 0109901840

Structure Descriptors

InChI

1S/C29H30N6OS/c1-21-9-7-8-12-23(21)20-31-33-29(37)35-27(17-18-30-24-13-15-25(16-14-24)34(2)3)32-26(28(35)36)19-22-10-5-4-6-11-22/h4-16,19-20,30H,17-18H2,1-3H3,(H,33,37)/b26-19+,31-20+

InChIKey

HRTLUAMWWYQTEY-DVIYFVMSSA-N

Smiles

Cc1ccccc1/C=N/NC(=S)N2C(=N/C(=C/c3ccccc3)/C2=O)CCNc4ccc(cc4)N(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral > 500mg/kg (500mg/kg)   Pharmazie. Vol. 42, Pg. 269, 1987.