N-[(6aS,8S)-2-(2,4-Difluorophenyl)-5,6,6a,7,8,9,10,12-octahydro-6,12-dioxopyrido[2,1-c][1,4]benzodiazepin-8-yl]-N'-(1-methylethyl)-urea
Product Code
TRC-D121250-25MG
CAS Number
Product Format
Neat
Molecular Formula
C23 H24 F2 N4 O3
Molecular Weight
442.459
Product Categories
Product Information
Chemical Data
Analyte Name
N-[(6aS,8S)-2-(2,4-Difluorophenyl)-5,6,6a,7,8,9,10,12-octahydro-6,12-dioxopyrido[2,1-c][1,4]benzodiazepin-8-yl]-N'-(1-methylethyl)-urea
CAS Number
1212715-50-8
Molecular Formula
C23 H24 F2 N4 O3
Molecular Weight
442.459
Accurate Mass
442.182
SMILES
CC(C)NC(=O)N[C@H]1CCN2[C@@H](C1)C(=O)Nc3ccc(cc3C2=O)c4ccc(F)cc4F
InChI
InChI=1S/C23H24F2N4O3/c1-12(2)26-23(32)27-15-7-8-29-20(11-15)21(30)28-19-6-3-13(9-17(19)22(29)31)16-5-4-14(24)10-18(16)25/h3-6,9-10,12,15,20H,7-8,11H2,1-2H3,(H,28,30)(H2,26,27,32)/t15-,20-/m0/s1
IUPAC
1-[(6aS,8S)-2-(2,4-difluorophenyl)-6,12-dioxo-5,6a,7,8,9,10-hexahydropyrido[2,1-c][1,4]benzodiazepin-8-yl]-3-propan-2-ylurea
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat