1-[2-[(1R)-2,3-Dihydro-5-(6-methyl-4-pyrimidinyl)-1H-inden-1-yl]-2,7-diazaspiro[3,5]non-7-yl]-2-(2-methylimidazo[2,1-b]thiazol-6-yl)ethanone结构式

中文名称:1-[2-[(1R)-2,3-Dihydro-5-(6-methyl-4-pyrimidinyl)-1H-inden-1-yl]-2,7-diazaspiro[3,5]non-7-yl]-2-(2-methylimidazo[2,1-b]thiazol-6-yl)ethanone
英文名称:PF-5190457
CAS No.:1334782-79-4
分子式:C29H32N6OS 分子量:512.668984413147
1-[2-[(1R)-2,3-Dihydro-5-(6-methyl-4-pyrimidinyl)-1H-inden-1-yl]-2,7-diazaspiro[3,5]non-7-yl]-2-(2-methylimidazo[2,1-b]thiazol-6-yl)ethanone 数据
Mol:
   4.8370   -5.0390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1261   -3.8822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8090    3.1537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8155   -4.8327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8090    4.1537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4833   -5.5770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    4.7415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1726   -6.5276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3090    5.6925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8405   -7.2718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0043    6.6388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1296   -6.1151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8090    7.2224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5298   -8.2224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8090    8.2224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 31  1  0
  1 35  1  0
  2 21  2  0
  3 10  1  0
  3 11  1  0
 14  3  1  1
  4 15  1  0
  4 16  1  0
  4 21  1  0
  5 27  1  0
  5 31  2  0
  6 28  2  0
  6 34  1  0
  7 29  1  0
  7 31  1  0
  7 33  1  0
  8 32  1  0
  8 34  2  0
  9 10  1  0
  9 11  1  0
  9 12  1  0
  9 13  1  0
 12 15  1  0
 13 16  1  0
 14 17  1  0
 14 18  1  0
 17 19  1  0
 18 20  2  0
 18 22  1  0
 19 20  1  0
 20 23  1  0
 21 25  1  0
 22 24  2  0
 23 26  2  0
 24 26  1  0
 25 27  1  0
 26 28  1  0
 27 29  2  0
 28 30  1  0
 30 32  2  0
 32 36  1  0
 33 35  2  0
 35 37  1  0
M  END                                
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1-[2-[(1R)-2,3-Dihydro-5-(6-methyl-4-pyrimidinyl)-1H-inden-1-yl]-2,7-diazaspiro[3,5]non-7-yl]-2-(2-methylimidazo[2,1-b]thiazol-6-yl)ethanone Smile 编码:
S1C(C)=CN2C1=NC(=C2)CC(N1CCC2(CC1)CN([C@H]1C3C=CC(C4C=C(C)N=CN=4)=CC=3CC1)C2)=O
1-[2-[(1R)-2,3-Dihydro-5-(6-methyl-4-pyrimidinyl)-1H-inden-1-yl]-2,7-diazaspiro[3,5]non-7-yl]-2-(2-methylimidazo[2,1-b]thiazol-6-yl)ethanone InChi 编码:
1S/C29H32N6OS/c1-19-11-25(31-18-30-19)22-3-5-24-21(12-22)4-6-26(24)35-16-29(17-35)7-9-33(10-8-29)27(36)13-23-15-34-14-20(2)37-28(34)32-23/h3,5,11-12,14-15,18,26H,4,6-10,13,16-17H2,1-2H3/t26-/m1/s1
1-[2-[(1R)-2,3-Dihydro-5-(6-methyl-4-pyrimidinyl)-1H-inden-1-yl]-2,7-diazaspiro[3,5]non-7-yl]-2-(2-methylimidazo[2,1-b]thiazol-6-yl)ethanone InChiKey 编码:
ZIUDADZJCKGWKR-AREMUKBSSA-N