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Substance Name: Tolvaptan, (S)-
RN: 331947-44-5
UNII: 08S1L9V25X
InChIKey: GYHCTFXIZSNGJT-DEOSSOPVSA-N

Molecular Formula

  • C26-H25-Cl-N2-O3

Molecular Weight

  • 448.9475
 
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Names and Synonyms

Name of Substance

  • Tolvaptan, (S)-

Synonyms

  • Benzamide, N-(4-(((5S)-7-chloro-2,3,4,5-tetrahydro-5-hydroxy-1H-1-benzazepin-1-yl)carbonyl)-3-methylphenyl)-2-methyl-
  • Tolvaptan, (S)-
  • UNII-08S1L9V25X

Registry Numbers

CAS Registry Number

  • 331947-44-5

FDA UNII

  • 08S1L9V25X

System Generated Number

  • 0331947445

Structure Descriptors

InChI

1S/C26H25ClN2O3/c1-16-6-3-4-7-20(16)25(31)28-19-10-11-21(17(2)14-19)26(32)29-13-5-8-24(30)22-15-18(27)9-12-23(22)29/h3-4,6-7,9-12,14-15,24,30H,5,8,13H2,1-2H3,(H,28,31)/t24-/m0/s1

InChIKey

GYHCTFXIZSNGJT-DEOSSOPVSA-N

Smiles

Cc1ccccc1C(=O)Nc2ccc(C(=O)N3CCC[C@H](O)c4cc(Cl)ccc34)c(C)c2