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Substance Name: Benzo(b)thiophen-3(2H)-one, 4-methoxy-7-(10-methoxy-5-methyl-4,5,6,7-tetrahydro-3H-furo(4,3,2-fg)(3)benzazocin-6-yl)-2-(phenylmethylene)-, 1,1-dioxide
RN: 155857-36-6
InChIKey: ZJZPZYBRCLQDRF-WZCUJZJLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H27-N-O6-S

Molecular Weight

  • 529.6103
 
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Names and Synonyms

  • Benzo(b)thiophen-3(2H)-one, 4-methoxy-7-(10-methoxy-5-methyl-4,5,6,7-tetrahydro-3H-furo(4,3,2-fg)(3)benzazocin-6-yl)-2-(phenylmethylene)-, 1,1-dioxide

Registry Numbers

CAS Registry Number

  • 155857-36-6

System Generated Number

  • 0155857366

Structure Descriptors

InChI

1S/C30H27NO6S/c1-17-9-11-23-27-21(16-37-23)24(36-3)15-31-14-20(26(17)27)19-10-12-22(35-2)28-29(32)25(38(33,34)30(19)28)13-18-7-5-4-6-8-18/h4-8,10,12-17,20,23H,9,11H2,1-3H3/b24-15+,25-13-,31-14-

InChIKey

ZJZPZYBRCLQDRF-WZCUJZJLSA-N

Smiles

CC1CCC2C3=C1C(/C=N\C=C(/C3=CO2)\OC)c4ccc(c5c4S(=O)(=O)/C(=C\c6ccccc6)/C5=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   Pharmaceutical Chemistry Journal Vol. 27, Pg. 834, 1993.