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Substance Name: (1)Benzothieno(3,2-b)pyridine-3-carboxylic acid, 1,4-dihydro-2-methyl-4-(2-nitrophenyl)-, methyl ester, 5,5-dioxide
RN: 105098-73-5
InChIKey: OJDQDMWFCTYBJV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H16-N2-O6-S

Molecular Weight

  • 412.4204
 
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Names and Synonyms

Synonym

  • 1-(2-Nitrophenyl)-2-methoxycarbonyl-3-methyl-1,4-dihydrobenzothieno(3,2-b)pyridine-9,9-dioxide

Systematic Name

  • (1)Benzothieno(3,2-b)pyridine-3-carboxylic acid, 1,4-dihydro-2-methyl-4-(2-nitrophenyl)-, methyl ester, 5,5-dioxide

Registry Numbers

CAS Registry Number

  • 105098-73-5

System Generated Number

  • 0105098735

Structure Descriptors

InChI

1S/C20H16N2O6S/c1-11-16(20(23)28-2)17(12-7-3-5-9-14(12)22(24)25)19-18(21-11)13-8-4-6-10-15(13)29(19,26)27/h3-10,17,21H,1-2H3

InChIKey

OJDQDMWFCTYBJV-UHFFFAOYSA-N

Smiles

CC1=C(C(C2=C(N1)c3ccccc3S2(=O)=O)c4ccccc4[N+](=O)[O-])C(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 7gm/kg (7000mg/kg)   U.S.S.R. Patent Document. Vol. #1018396,