Compound Search
化合物数据库
基于 PubChem CID 索引，支持名称 / 同义词 / CAS / SMILES 检索。
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TERT-BUTYL (R)-2-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-3,6-DIHYDROPYRIDINE-1(2H)-CARBOXYLATE PubChem CID 170907008
C[C@@H]1C=C(B2OC(C)(C)C(C)(C)O2)CCN1C(=O)OC(C)(C)C.C[C@@H]1CC(B2OC(C)(C)C(C)(C)O2)=CCN1C(=O)OC(C)(C)C -
trimethyltridecyl)chroman-6-yl (E)-2-((2-((4R,6R)-6-(2-(tert-butoxy)-2-oxoethyl)-2,2-dimethyl-1,3-dioxan-4- PubChem CID 170919331
C/C(=C\C(C(=O)NCC[C@@H]1C[C@H](CC(=O)OC(C)(C)C)OC(C)(C)O1)C(=O)Oc1c(C)c(C)c2c(c1C)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2)c1ccccc1 -
Compound 4 5-hydroxy-2,6-dimethyl-4H-chromen-4-one PubChem CID 170989896
Cc1cc(=O)c2c(O)c(C)ccc2o1 -
sulfuric acid compound with ethyl (S)-2-amino-4-fluoro-4-methylpentanoate and pyridine (5:1:2) CAS 1459196-65-6 PubChem CID 171034099
CCOC(=O)[C@@H](N)CC(C)(C)F.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.c1ccncc1.c1ccncc1 -
(R)-2-(4-hydroxyphenyl)propanoic acid compound with 2-(4-hydroxyphenyl)propanoic acid (2:1) CAS 59092-88-5 PubChem CID 171035665
CC(C(=O)O)c1ccc(O)cc1.CC(C(=O)O)c1ccc(O)cc1.CC(C(=O)O)c1ccc(O)cc1 -
(R)-2-Chloro-N-[(S)-1-(4-chlorophenyl)-3-hydroxypropan-2-yl]propanamide compound with (S)-2-Chloro-N- PubChem CID 171363623
C[C@@H](Cl)C(=O)N[C@H](CO)Cc1ccc(Cl)cc1.C[C@H](Cl)C(=O)N[C@H](CO)Cc1ccc(Cl)cc1 -
(2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide compound CAS 4888-97-5 PubChem CID 171370205
CC1(C)[C@H](C(=O)O)N2C(=O)[C@@H](N)[C@H]2S1=O.O=C(O)C(F)(F)F -
1-((4-Chlorophenyl)(phenyl)methyl)-4-(2-methylbenzyl)piperazine Dihydrochloride Monohydrate; USP Meclizine PubChem CID 171379794
Cc1ccccc1CN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1.Cl.Cl.O -
-butanedioic Acid Compound with (aR)?-?a-?[3-?[[2-?(3,?4-?Dimethoxyphenyl)?ethyl]?methylamino]? PubChem CID 171380865
O=C(O)O[C@H](C(=O)O)[C@H](OC(=O)c1ccccc1)C(=O)O.[2H]C([2H])([2H])C(C([2H])([2H])[2H])[C@](C#N)(CCCN(C)CCc1ccc(OC)c(OC)c1)c1ccc(OC)c(OC)c1 -
1-((4-Chlorophenyl)(phenyl)methyl)-4-(2-methylbenzyl)piperazine Dihydrochloride Monohydrate; USP Meclizine PubChem CID 171382093
Cl.Cl.[2H]C1([2H])N(Cc2ccccc2C)C([2H])([2H])C([2H])([2H])N(C(c2ccccc2)c2ccc(Cl)cc2)C1([2H])[2H] -
4-Chloro-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazine Dihydrochloride; Prochlorperazine Related CAS 1346602-34-3 PubChem CID 171382761
CN1CCN(CCCN2c3ccccc3Sc3c(Cl)cccc32)CC1.Cl.Cl -
N6-Cyclopropyl-d4-9-((1R,4S)-4-(((2,5-diamino-6-chloropyrimidin-4-yl)oxy)methyl)cyclopent-2-en-1-yl)- PubChem CID 171394344
[2H]C1([2H])C(Nc2nc(N)nc3c2ncn3[C@H]2C=C[C@@H](COc3nc(N)nc(Cl)c3N)C2)C1([2H])[2H] -
1-(4-(2-(4- bromophenyl)propan-2- yl)thiazol-2-yl)-3-((2- (piperazin-1- yl)pyrimidin-5- yl)methyl)urea PubChem CID 171407416
CC(C)(c1ccc(Br)cc1)c1csc(NC(=O)NCc2cnc(N3CCNCC3)nc2)n1 -
TERT-BUTYL 1,2,3,3A-TETRAHYDRO-4H-DICYCLOPENTA[B,C]AZETE-4-CARBOXYLATE COMPOUND WITH TERT-BUTYL 1,3A, PubChem CID 171935481
CC(C)(C)OC(=O)N1C2=CC=CC23CCCC13.CC(C)(C)OC(=O)N1C2C=CCC23CC=CC13 -
2-amino-4-(2-aminophenyl-3,4,5,6-d4)-4-oxobutanoic acid compound with 2,2,2-trifluoroacetic acid (1:1 CAS 2241865-40-5 PubChem CID 172405492
O=C(O)C(F)(F)F.[2H]c1c([2H])c([2H])c(C(=O)CC(N)C(=O)O)c(N)c1[2H] -
2-amino-4-(2-aminophenyl)-4-oxobutanoic-2,3,3-d3 acid compound with 2,2,2-trifluoroacetic acid (1:1) CAS 2241865-42-7 PubChem CID 172405500
O=C(O)C(F)(F)F.[2H]C([2H])(C(=O)c1ccccc1N)C([2H])(N)C(=O)O -
N-(2-chloro-4-(trifluoromethyl)phenyl)-2-(2-(dimethylamino)-6-ethyl- 7-(5-(5-hydroxy-6-methylpyrimidine PubChem CID 172629526
CCc1c(N2C[C@@H]3CC[C@H]2CN3C(=O)c2ncnc(C)c2O)c(=O)c2nc(N(C)C)cnc2n1CC(=O)Nc1ccc(C(F)(F)F)cc1Cl -
N-(2-chloro-4-(trifluoromethyl)phenyl)-2-(2-(dimethylamino)-6-ethyl- 7-(-5-(5-hydroxy-6-methylpyrimidine PubChem CID 172629921
CCc1c(N2CCN(C(=O)c3ncnc(C)c3O)[C@H]3CC[C@@H]32)c(=O)c2nc(N(C)C)cnc2n1CC(=O)Nc1ccc(C(F)(F)F)cc1Cl -
US9688684, Compound 11: 8-(4-Fluoro-phenyl)-7-(3-isopropyl-1-phenyl-1H-pyrazol-4-ylmethyl)-5,6,7,8-tetrahydro-tetrazolo PubChem CID 172636508
CC(C)c1nn(-c2ccccc2)cc1CN1CCN2NN=NC2C1c1ccc(F)cc1 -
(1R,2R)-1,2-dihydroxyethane-1,2-diyl dibenzoate compound with (S)-4-(4-cyano-2-methoxyphenyl)-5-ethoxy CAS 3046141-68-5 PubChem CID 172970065
CCOc1ncc(C)c2c1[C@H](c1ccc(C#N)cc1OC)C(C(N)=O)=C(C)N2.O=C(O[C@@H](O)[C@H](O)OC(=O)c1ccccc1)c1ccccc1