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Substance Name: Benzamide, N-(4-methyl-2-sulfamoyl-delta(sup 2)-1,3,4-thiadiazolin-5-ylidene)-3,4,5-trimethoxy-
RN: 55217-91-9
InChIKey: HFHDIWTUXZNDTJ-NTCAYCPXSA-N

Molecular Formula

  • C13-H16-N4-O6-S2

Molecular Weight

  • 388.4234
 
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Names and Synonyms

Synonyms

  • 3-Methyl-2-(3,4,5-trimethoxybenzoylimino)-delta(sup 4)-1,3,4-thiadiazoline-5-sulfonamide
  • 4-Methyl-5-(3,4,5-trimethoxybenzoylimino)-delta(sup 2)-1,3,4-thiadiazoline-2-sulfonamide
  • BRN 5412115

Systematic Name

  • Benzamide, N-(4-methyl-2-sulfamoyl-delta(sup 2)-1,3,4-thiadiazolin-5-ylidene)-3,4,5-trimethoxy-

Registry Numbers

CAS Registry Number

  • 55217-91-9

System Generated Number

  • 0055217919

Structure Descriptors

InChI

1S/C13H16N4O6S2/c1-17-12(24-13(16-17)25(14,19)20)15-11(18)7-5-8(21-2)10(23-4)9(6-7)22-3/h5-6H,1-4H3,(H2,14,19,20)/b15-12+

InChIKey

HFHDIWTUXZNDTJ-NTCAYCPXSA-N

Smiles

Cn1/c(=N\C(=O)c2cc(c(c(c2)OC)OC)OC)/sc(n1)S(=O)(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1930mg/kg (1930mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 18, Pg. 351, 1975.