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Substance Name: Acrylic acid, 2-(diethylaminomethyl)-3,3-di-2-thienyl-, ethyl ester, picrolonate
ID: AS83000000
InChIKey: QYMJFGFGTKNQAI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H23-N-O2-S2.C10-H8-N4-O5

Molecular Weight

  • 613.7129
 
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Names and Synonyms

Synonym

  • 2-(Diethylaminomethyl)-3,3-di-2-thienylacrylic acid ethyl ester picrolonate

Systematic Name

  • Acrylic acid, 2-(diethylaminomethyl)-3,3-di-2-thienyl-, ethyl ester, picrolonate

Registry Numbers

ID Number

  • NIOSH/AS8300000

System Generated Number

  • AS83000000

Molecular Formulas

Molecular Formula

  • C18-H23-N-O2-S2.C10-H8-N4-O5

Molecular Formula Fragments

  • C10-H8-N4-O5
  • C18-H23-N-O2-S2
  • COMPONENT

Structure Descriptors

InChI

1S/C18H23NO2S2.C10H8N4O5/c1-4-19(5-2)13-14(18(20)21-6-3)17(15-9-7-11-22-15)16-10-8-12-23-16;1-6-9(14(18)19)10(15)12(11-6)7-2-4-8(5-3-7)13(16)17/h7-12H,4-6,13H2,1-3H3;2-5,9H,1H3

InChIKey

QYMJFGFGTKNQAI-UHFFFAOYSA-N

Smiles

CCOC(=O)C(=C(c1cccs1)c2cccs2)CN(CC)CC.CC3=NN(C(=O)C3[N+](=O)[O-])c4ccc(cc4)[N+](=O)[O-]