N-[5-[3-[[(4-Hydroxyphenyl)amino]sulfonyl]-4-methoxyphenyl]-4-methyl-2-thiazo...
C22H25N3O5S2
1881233-39-1 Copyright (C) 2023 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  32 34 0 0 0
M  V30 BEGIN ATOM
M  V30 1 S 6.9300 5.3779 0.0 0 VAL=6
M  V30 2 N 6.1600 6.7117 0.0 0
M  V30 3 O 8.2637 6.1479 0.0 0
M  V30 4 O 5.5964 4.6079 0.0 0
M  V30 5 O 5.3900 2.7106 0.0 0
M  V30 6 C 4.6200 1.3769 0.0 0
M  V30 7 C 11.9793 0.0000 0.0 0
M  V30 8 N 15.1657 4.3858 0.0 0
M  V30 9 C 16.5726 3.7593 0.0 0
M  V30 10 C 17.8185 4.6645 0.0 0
M  V30 11 O 16.7336 2.2278 0.0 0
M  V30 12 C 16.9133 5.9104 0.0 0
M  V30 13 C 19.0644 5.5697 0.0 0
M  V30 14 C 18.7237 3.4187 0.0 0
M  V30 15 O 0.0000 6.7117 0.0 0
M  V30 16 C 7.7000 4.0442 0.0 0
M  V30 17 C 6.9300 2.7106 0.0 0
M  V30 18 C 9.2400 4.0442 0.0 0
M  V30 19 C 7.7000 1.3769 0.0 0
M  V30 20 C 10.0101 2.7106 0.0 0
M  V30 21 C 9.2400 1.3769 0.0 0
M  V30 22 C 11.5501 2.7106 0.0 0
M  V30 23 S 12.4553 3.9564 0.0 0
M  V30 24 C 12.4553 1.4647 0.0 0
M  V30 25 C 13.9198 3.4806 0.0 0
M  V30 26 N 13.9198 1.9406 0.0 0
M  V30 27 C 4.6200 6.7117 0.0 0
M  V30 28 C 3.8500 8.0453 0.0 0
M  V30 29 C 3.8500 5.3779 0.0 0
M  V30 30 C 2.3100 8.0453 0.0 0
M  V30 31 C 2.3100 5.3779 0.0 0
M  V30 32 C 1.5400 6.7117 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 2 1 3
M  V30 3 2 1 4
M  V30 4 1 1 16
M  V30 5 1 2 27
M  V30 6 1 5 6
M  V30 7 1 5 17
M  V30 8 1 7 24
M  V30 9 1 8 9
M  V30 10 1 8 25
M  V30 11 1 9 10
M  V30 12 2 9 11
M  V30 13 1 10 12
M  V30 14 1 10 13
M  V30 15 1 10 14
M  V30 16 1 15 32
M  V30 17 2 16 17
M  V30 18 1 16 18
M  V30 19 1 17 19
M  V30 20 2 18 20
M  V30 21 2 19 21
M  V30 22 1 20 21
M  V30 23 1 20 22
M  V30 24 1 22 23
M  V30 25 2 22 24
M  V30 26 1 23 25
M  V30 27 1 24 26
M  V30 28 2 25 26
M  V30 29 2 27 28
M  V30 30 1 27 29
M  V30 31 1 28 30
M  V30 32 2 29 31
M  V30 33 2 30 32
M  V30 34 1 31 32
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
1881233-39-1

> <cas.index.name>
Propanamide, N-[5-[3-[[(4-hydroxyphenyl)amino]sulfonyl]-4-methoxyphenyl]-4-methyl-2-thiazolyl]-2,2-dimethyl-

> <molecular.formula>
C22H25N3O5S2

> <molecular.weight>
475.58

> <density.predicted>
1.367±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
9.06±0.10    Most Acidic Temp: 25 °C

$$$$
