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Substance Name: Ro 18-3981
RN: 103295-92-7
InChIKey: VEZRCCZBPXTSNZ-UHFFFAOYSA-N

Molecular Formula

  • C24-H33-N3-O8-S

Molecular Weight

  • 523.6037
 
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Names and Synonyms

Name of Substance

  • Ro 18-3981

Synonyms

  • 2-Propoxyethyl-1,4-dihydro-5-((isopropylsulfamoyl)acetyl)-2,6-dimethyl-4-(3-nitrophenyl)nicotinate
  • RO-183981

Systematic Name

  • 3-Pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-((((1-methylethyl)amino)sulfonyl)acetyl)-4-(3-nitrophenyl)-, 2-propoxyethyl ester

Registry Numbers

CAS Registry Number

  • 103295-92-7

System Generated Number

  • 0103295927

Structure Descriptors

InChI

1S/C24H33N3O8S/c1-6-10-34-11-12-35-24(29)22-17(5)25-16(4)21(20(28)14-36(32,33)26-15(2)3)23(22)18-8-7-9-19(13-18)27(30)31/h7-9,13,15,23,25-26H,6,10-12,14H2,1-5H3

InChIKey

VEZRCCZBPXTSNZ-UHFFFAOYSA-N

Smiles

CCCOCCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)CS(=O)(=O)NC(C)C)C)C