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Substance Name: Thieno(2,3-c)pyridine, 4,5,6,7-tetrahydro-4-(4-chlorophenyl)-6-methyl-2-(4-morpholinylmethyl)-, (Z)-2-butenedioate (1:2)
RN: 88013-35-8
InChIKey: SUEAEUIVQZRNET-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-Cl-N2-O-S.2C4-H4-O4

Molecular Weight

  • 595.0659
 
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Names and Synonyms

  • Thieno(2,3-c)pyridine, 4,5,6,7-tetrahydro-4-(4-chlorophenyl)-6-methyl-2-(4-morpholinylmethyl)-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 88013-35-8

System Generated Number

  • 0088013358

Molecular Formulas

Molecular Formula

  • C19-H23-Cl-N2-O-S.2C4-H4-O4

Molecular Formula Fragments

  • C19-H23-Cl-N2-O-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H23ClN2OS.2C4H4O4/c1-21-12-18(14-2-4-15(20)5-3-14)17-10-16(24-19(17)13-21)11-22-6-8-23-9-7-22;2*5-3(6)1-2-4(7)8/h2-5,10,18H,6-9,11-13H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

SUEAEUIVQZRNET-LVEZLNDCSA-N

Smiles

CN1CC(c2c(sc(c2)CN3CCOCC3)C1)c4ccc(cc4)Cl.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 640mg/kg (640mg/kg)   United States Patent Document. Vol. #4550106,