Smiles:
CC1=CC=CC=C1C2=CC(=NC=C2N(C)C(=O)C(C)(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCN(CC4)C

InChIKey:
WAXQNWCZJDTGBU-UHFFFAOYSA-N

InChI:

InChI=1S/C30H32F6N4O/c1-19-8-6-7-9-23(19)24-17-26(40-12-10-38(4)11-13-40)37-18-25(24)39(5)27(41)28(2,3)20-14-21(29(31,32)33)16-22(15-20)30(34,35)36/h6-9,14-18H,10-13H2,1-5H3

InChIcol:
1

More information (from its Standard Form):

Netupitant

Complex structures in which this molecule appears :

Complex Structure ID: 654 Complex Structure ID: 951

Download the SDF file