Ubrogepant D5

Product Name Ubrogepant D5
Alternate Names Ubrogepant Stable Isotopes, Stable Isotopes of Ubrogepant
CAT No. CS-O-36178
CAS No. 1374248-77-7 (Unlabeled)
Category Stable Isotopes
Stock Enquire
Mol. Wt. 554.57 g/mol
Mol. For. C29H21D5F3N5O3
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Ubrogepant
Canonical Smiles CC1C(CC(C(=O)N1CC(F)(F)F)NC(=O)C2=CC3=C(CC4(C3)C5=C(NC4=O)N=CC=C5)N=C2)C6=CC=CC=C6
InchIKey DDOOFTLHJSMHLN-ZQHRPCGSSA-N
Inchl InChI=1S/C29H26F3N5O3/c1-16-20(17-6-3-2-4-7-17)11-22(26(39)37(16)15-29(30,31)32)35-25(38)19-10-18-12-28(13-23(18)34-14-19)21-8-5-9-33-24(21)36-27(28)40/h2-10,14,16,20,22H,11-13,15H2,1H3,(H,35,38)(H,33,36,40)/t16-,20-,22+,28+/m1/s1
IUPAC (3S)-N-[(3S,5S,6R)-6-methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-3'-carboxamide
Controlled No
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