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Substance Name: Acetamide, N-(4-(((5-(1-(3-chlorophenyl)-4-methoxy-5-((4-nitrophenyl)azo)-1H-pyrazol-3-yl)-1,3,4-thiadiazol-2-yl)amino)sulfonyl)phenyl)-
RN: 172701-63-2
InChIKey: NNJUWCZZCXGEOF-QVIHXGFCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H20-Cl-N9-O6-S2

Molecular Weight

  • 654.086
 
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Names and Synonyms

  • Acetamide, N-(4-(((5-(1-(3-chlorophenyl)-4-methoxy-5-((4-nitrophenyl)azo)-1H-pyrazol-3-yl)-1,3,4-thiadiazol-2-yl)amino)sulfonyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 172701-63-2

System Generated Number

  • 0172701632

Structure Descriptors

InChI

1S/C26H20ClN9O6S2/c1-15(37)28-17-8-12-21(13-9-17)44(40,41)34-26-32-31-25(43-26)22-23(42-2)24(35(33-22)20-5-3-4-16(27)14-20)30-29-18-6-10-19(11-7-18)36(38)39/h3-14H,1-2H3,(H,28,37)(H,32,34)/b30-29+

InChIKey

NNJUWCZZCXGEOF-QVIHXGFCSA-N

Smiles

CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nnc(s2)c3c(c(n(n3)c4cccc(c4)Cl)/N=N/c5ccc(cc5)[N+](=O)[O-])OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 175mg/kg (175mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 45, Pg. 1074, 1995.