CAS Registry Number®
274901-16-5
CAS Name
Vildagliptin
Molecular Formula
C17H25N3O2
Molecular Mass
303.40
Compound Properties
-
Melting Point (1)
148-150 °C
Source(s)
- (1) Villhauer, Edwin B.; Journal of Medicinal Chemistry, (2003), 46(13), 2774-2789, CAplus
Other Names and Identifiers
InChI
InChI=1S/C17H25N3O2/c18-9-14-2-1-3-20(14)15(21)10-19-16-5-12-4-13(6-16)8-17(22,7-12)11-16/h12-14,19,22H,1-8,10-11H2/t12?,13?,14-,16?,17?/m0/s1
InChIKey
InChIKey=SYOKIDBDQMKNDQ-XWTIBIIYSA-N
SMILES
N(CC(=O)N1[C@H](C#N)CCC1)C23CC4(O)CC(C2)CC(C3)C4
Canonical SMILES
N#CC1N(C(=O)CNC23CC4CC(CC(O)(C4)C2)C3)CCC1
Other Names for this Substance
- 2-Pyrrolidinecarbonitrile, 1-[2-[(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)amino]acetyl]-, (2S)-
- 2-Pyrrolidinecarbonitrile, 1-[[(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)amino]acetyl]-, (2S)-
- (2S)-1-[2-[(3-Hydroxytricyclo[3.3.1.13,7]dec-1-yl)amino]acetyl]-2-pyrrolidinecarbonitrile
- Vildagliptin
- LAF 237
- NVP-LAF 237
- Galvus
- Equa
- DSP 7238
- (S)-1-[2-[(3-Hydroxyadamant-1-yl)amino]acetyl]pyrrolidine-2-carbonitrile
- (2S)-1-[2-[(3-Hydroxy-1-adamantyl)amino]acetyl]pyrrolidine-2-carbonitrile
- Xiliarx
- Jalra
- (2S)-1-[[(3-Hydroxytricyclo[3.3.1.13,7]dec-1-yl)amino]acetyl]-pyrrolidine-2-carbonitrile
Deleted or Replaced CAS Registry Numbers
565453-38-5
