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Substance Name: Ethanethioic acid, (naphthalenylamino)-, S-(5-(4,5-dihydro-4-((1H-indol-3-yl)methylene)-2-methyl-5-oxo-1H-imidazol-1-yl)-1,3,4-thiadiazol-2-yl) ester
RN: 127216-76-6
InChIKey: OSLXLKSAYIQKPA-YDZHTSKRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H20-N6-O2-S2

Molecular Weight

  • 524.627
 
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Names and Synonyms

  • Ethanethioic acid, (naphthalenylamino)-, S-(5-(4,5-dihydro-4-((1H-indol-3-yl)methylene)-2-methyl-5-oxo-1H-imidazol-1-yl)-1,3,4-thiadiazol-2-yl) ester

Registry Numbers

CAS Registry Number

  • 127216-76-6

System Generated Number

  • 0127216766

Structure Descriptors

InChI

1S/C27H20N6O2S2/c1-16-30-23(13-18-14-28-21-11-5-4-10-20(18)21)25(35)33(16)26-31-32-27(37-26)36-24(34)15-29-22-12-6-8-17-7-2-3-9-19(17)22/h2-14,28-29H,15H2,1H3/b23-13+

InChIKey

OSLXLKSAYIQKPA-YDZHTSKRSA-N

Smiles

CC1=N/C(=C/c2c[nH]c3c2cccc3)/C(=O)N1c4nnc(s4)SC(=O)CNc5cccc6c5cccc6

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 900mg/kg (900mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 29, Pg. 85, 1990.