Urea, N-[(4S)-8-chloro-3,4-dihydro-2H-1-benzopyran-4-yl]-N′-(1-phenyl-1H-pyra...
C19H17ClN4O2
3068830-89-4 Copyright (C) 2025 ACS
 26 29  0  0  1  0  0  0  0  0999 V2000
    6.6684    2.3100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0020    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3358    2.3100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0020    4.6200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.0800    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.0011    2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3347    3.0800    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.0011    0.7700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    4.6200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3347    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011    5.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3336    0.7700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6695    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0763    2.4537    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.8304    4.6116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1069    3.5981    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3368    4.9317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6384    3.4371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5436    4.6830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2647    2.0302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0751    4.5221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7962    1.8693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7015    3.1151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  8  1  1  6  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  3 16  1  0  0  0  0
  5 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  2  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  2  0  0  0  0
 24 26  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
> <cas.rn>
3068830-89-4

> <cas.index.name>
Urea, N-[(4S)-8-chloro-3,4-dihydro-2H-1-benzopyran-4-yl]-N′-(1-phenyl-1H-pyrazol-3-yl)-

> <molecular.formula>
C19H17ClN4O2

> <molecular.weight>
368.82

> <boiling.point.predicted>
525.502±50.00 °C    Press: 760.00 Torr

> <density.predicted>
1.406±0.14 g/cm3    Temp: 25 °C; Press: 760 Torr

$$$$
