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Substance Name: EMD 53998
RN: 120223-04-3
UNII: 3L67D8JK8X
InChIKey: IZLRMTJLQCLMKF-UHFFFAOYSA-N

Note

  • EMD 53998 is racemic; EMD 57439 is the (-)-isomer; EMD 57033 is the (+)-isomer.

Molecular Formula

  • C22-H23-N3-O4-S

Molecular Weight

  • 425.5067
 

Classification Codes

  • Cardiotonic Agents
  • Cardiovascular Agents
  • Enzyme Inhibitors
  • Phosphodiesterase Inhibitors
  • Protective Agents
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Names and Synonyms

Name of Substance

  • EMD 53998

Synonyms

  • 5-(1-(3,4-Dimethoxybenzoyl)-1,2,3,4-tetrahydrochinolin-6-yl)-6-methyl-3,6-dihydro-2H-1,3,4-thiadiazin-2-on
  • EMD 53,998
  • EMD 53998
  • Emd-53998
  • UNII-3L67D8JK8X

Systematic Name

  • Quinoline, 6-(3,6-dihydro-6-methyl-2-oxo-2H-1,3,4-thiadiazin-5-yl)-1-(3,4-dimethoxybenzoyl)-1,2,3,4-tetrahydro-

Registry Numbers

CAS Registry Number

  • 120223-04-3

FDA UNII

  • 3L67D8JK8X

Other Registry Number

  • 150151-10-3

System Generated Number

  • 0120223043

Structure Descriptors

InChI

1S/C22H23N3O4S/c1-13-20(23-24-22(27)30-13)15-6-8-17-14(11-15)5-4-10-25(17)21(26)16-7-9-18(28-2)19(12-16)29-3/h6-9,11-13H,4-5,10H2,1-3H3,(H,24,27)

InChIKey

IZLRMTJLQCLMKF-UHFFFAOYSA-N

Smiles

CC1C(=NNC(=O)S1)c2ccc3c(c2)CCCN3C(=O)c4ccc(c(c4)OC)OC