部分構造検索

539168

CNC(=O)C(Cc1ccc2ccccc2c1)N1CCN(C(=O)OC(C)(C)C)C(CCO)C1
Reaction #8627
desired product
DOI: 10.6084/m9.figshare.5104873.v1
CCOc1ccc(NC(=O)C2CNCCN2)cc1-c1nn2c(C3CCCC3)nc(C)c2c(=O)[nH]1
Reaction #11376
2-[2-Ethoxy-5-((±)-piperazine-2-carbonylamino)phenyl]-5-methyl-7-cyclopentyl-3H-imidazo[5,1-f][1,2,4]-triazin-4-one
DOI: 10.6084/m9.figshare.5104873.v1
CC(C)(C)OC(=O)N1CCN(Cc2cccc(-c3ccnc(Cl)n3)c2)CC1Cc1c[nH]c2ccccc12
Reaction #43163
4-[3-(2-Chloro-pyrimidin-4-yl)-benzyl]-2-(1H-indol-3-ylmethyl)-piperazine-1-carboxylic acid tert-butyl ester
DOI: 10.6084/m9.figshare.5104873.v1
Oc1ccc(CCNc2nccc(-c3cccc(CN4CCN[C@@H](Cc5c[nH]c6ccccc56)C4)c3)n2)cc1
Reaction #43164
4-[2-(4-{3-[3(S)-(1H-Indol-3-ylmethyl)-piperazin-1-ylmethyl]-phenyl}-pyrimidin-2-ylamino)-ethyl]-phenol
DOI: 10.6084/m9.figshare.5104873.v1
Fc1cc(F)cc(CCNc2nccc(-c3cccc(CN4CCN[C@@H](Cc5c[nH]c6ccccc56)C4)c3)n2)c1
Reaction #43181
[2-(3,5-Difluoro-phenyl)-ethyl]-(4-{3-[3(S)-(1H-indol-3-ylmethyl)-piperazin-1-ylmethyl]-phenyl}-pyrimidin-2-yl)-amine
DOI: 10.6084/m9.figshare.5104873.v1
c1cc(-c2cncc(N3C[C@@H]4C[C@H]3CN4)c2)cs1
Reaction #51702
oil
収率 34.4%DOI: 10.6084/m9.figshare.5104873.v1
CC(C)(C)OC(=O)N1C2CCC1CN(c1ccc(N3CCN(S(C)(=O)=O)CC3)cc1)C2
Reaction #68982
3-[4-(4-methanesulfonylpiperazin-1-yl)phenyl]-3,8-diazabicyclo[3.2.1]-octane-8-carboxylic acid tert-butyl ester
収率 97.9%DOI: 10.6084/m9.figshare.5104873.v1
CC(C)(C)OC(=O)N1CCNCC1COc1cccnc1
Reaction #157383
desired product
収率 87.1%DOI: 10.6084/m9.figshare.5104873.v1
CC(C)NC(=O)CNC(=O)c1cc(N2C[C@@H]3C[C@H]2CN3C(=O)OC(C)(C)C)ccc1[N+](=O)[O-]
Reaction #164554
(1S,4S)-tert-butyl 5-(3-(2-(isopropylamino)-2-oxoethylcarbamoyl)-4-nitrophenyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
収率 92.1%DOI: 10.6084/m9.figshare.5104873.v1
CC(C)NC(=O)CNC(=O)c1cc(N2C[C@@H]3C[C@H]2CN3)ccc1[N+](=O)[O-]
Reaction #164559
5-((1S,4S)-2,5-diazabicyclo[2.2.1]heptan-2-yl)-N-(2-(isopropylamino)-2-oxoethyl)-2-nitrobenzamide
収率 83.7%DOI: 10.6084/m9.figshare.5104873.v1
C[C@@H]1CN(c2ccc(Cl)nn2)CCN1C(=O)OC(C)(C)C
Reaction #166290
compound 11
収率 82.0%DOI: 10.6084/m9.figshare.5104873.v1
C[C@@H]1CN(c2ccc(Nc3ncc4c5ccnc(F)c5n(C5CCCC5)c4n3)nn2)CCN1
Reaction #166418
Compound 408
収率 12.0%DOI: 10.6084/m9.figshare.5104873.v1
Cc1cccc(C)c1-c1nc2c(c(N3C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]3C)n1)CN(Cc1ccccc1)CC2
Reaction #167968
title compound
DOI: 10.6084/m9.figshare.5104873.v1
Cc1ccc(C(C)C)cc1N1CCc2nc(-c3c(C)cccc3C)nc(N3C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]3C)c2C1
Reaction #167970
racemic tert-butyl 4-(2-(2,6-dimethylphenyl)-6-(5-isopropyl-2-methylphenyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl)-(trans)-2,5-dimethylpiperazine-1-carboxylate
DOI: 10.6084/m9.figshare.5104873.v1
Cc1ccc(C(C)C)cc1N1CCc2nc(-c3c(C)cccc3C)nc(N3C[C@@H](C)NC[C@@H]3C)c2C1
Reaction #167971
2-(2,6-dimethylphenyl)-4-((trans)-2,5-dimethylpiperazin-1-yl)-6-(5-isopropyl-2-methylphenyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
DOI: 10.6084/m9.figshare.5104873.v1
CC1(C)CN(c2c(F)cccc2F)C(=O)CN1
Reaction #173766
DOI: 10.1039/C8SC04228D
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CN3CC4CC3CN4)n(C)c2n1
Reaction #174198
DOI: 10.1039/C8SC04228D
COc1ccc(-c2nnc(N3CCN(C(=O)OC(C)(C)C)C(C)C3)c3ccccc23)cc1
Reaction #175914
DOI: 10.1039/C8SC04228D
Cc1ccc2c(N3CCN(C(=O)OC(C)(C)C)C(COCc4ccccc4)C3)nc(-c3ccccc3O)nc2c1
Reaction #179824
DOI: 10.1039/C8SC04228D
CC(C)(C)OC(=O)N1CC(=O)N(c2c(F)cccc2F)CC1(C)C
Reaction #189323
DOI: 10.1039/C8SC04228D
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