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Substance Name: Rolapitant [USAN:INN]
RN: 552292-08-7
UNII: NLE429IZUC
InChIKey: FIVSJYGQAIEMOC-ZGNKEGEESA-N

Note

  • An anti-emetic agent.

Molecular Formula

  • C25-H26-F6-N2-O2

Molecular Weight

  • 500.4804
 

Classification Codes

  • Neurokinin-1 Receptor Antagonists
  • Neurotransmitter Agents
  • Prevention of Nausea and Vomiting

Names and Synonyms

Name of Substance

  • Rolapitant [USAN:INN]

Synonyms

  • Rolapitant
  • SCH 619734
  • SCH-619734
  • UNII-NLE429IZUC
  • Varubi

Registry Numbers

CAS Registry Number

  • 552292-08-7

FDA UNII

  • NLE429IZUC

System Generated Number

  • 0552292087

Structure Descriptors

InChI

1S/C25H26F6N2O2/c1-16(17-11-19(24(26,27)28)13-20(12-17)25(29,30)31)35-15-23(18-5-3-2-4-6-18)10-9-22(14-32-23)8-7-21(34)33-22/h2-6,11-13,16,32H,7-10,14-15H2,1H3,(H,33,34)/t16-,22-,23-/m1/s1

InChIKey

FIVSJYGQAIEMOC-ZGNKEGEESA-N

Smiles

C[C@@H](OC[C@]1(CC[C@]2(CCC(=O)N2)CN1)c3ccccc3)c4cc(cc(c4)C(F)(F)F)C(F)(F)F