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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O=P1(N(CCCl)CCCl)N[C@@H](O)CCO1 -
(5RS)-5-((4-(2-(5-Ethylpyridin-2-yl)ethoxy)phenyl)methyl)-5-hydroxythiazolidine-2,4-dione CAS 625853-74-9 PubChem CID 46781869
CCc1ccc(CCOc2ccc(CC3(O)SC(=O)NC3=O)cc2)nc1 -
Isoprene-d7 (Major) PubChem CID 46781993
[2H]C=C([2H])C(=C([2H])[2H])C([2H])([2H])[2H] -
N-[4-[[4-(Dimethylamino)phenyl]phenyl-d5-methylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium Chloride PubChem CID 46782096
[2H]c1c([2H])c([2H])c(C(=C2C=CC(=[N+](C)C)C=C2)c2ccc(N(C)C)cc2)c([2H])c1[2H].[Cl-] -
(S)-[2,8-Bis(trifluoromethyl)quinolin-4-yl][(2R)-(2,3,3,4,4,5,5,6,6-~2~H_9_)piperidin-2-yl]methanol--hydrogen chloride (1/1) CAS 1217653-15-0 PubChem CID 46782113
Cl.[2H]C1([2H])N[C@@]([2H])([C@@H](O)c2cc(C(F)(F)F)nc3c(C(F)(F)F)cccc23)C([2H])([2H])C([2H])([2H])C1([2H])[2H] -
8-Chloro-6-(2-fluorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-d5 CAS 395067-42-2 PubChem CID 46782372
[2H]c1cc([2H])c(F)c(C2=NC([2H])([2H])c3c([2H])nc(C)n3-c3ccc(Cl)cc32)c1 -
NC(=O)N1c2ccccc2C=C(OS(=O)(=O)O)c2ccccc21 -
Ziprasidone Related Compound B; 1H-Indole-2,3-dione, 5-[2-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]ethyl]-6-chloro- CAS 1159977-56-6 PubChem CID 46782656
O=C1Nc2cc(Cl)c(CCN3CCN(c4nsc5ccccc45)CC3)cc2C1=O -
Quinoxalino[2,3-b]phenazine-2,9-disulfonicacid, 5,12-dihydro-, sodium salt (1:2) CAS 3863-80-7 PubChem CID 46782716
O=S(=O)([O-])c1ccc2c(c1)Nc1cc3nc4ccc(S(=O)(=O)[O-])cc4nc3cc1N2.[Na+].[Na+] -
4,6-Dioxoheptanoic acid-3,4,5,6,7-13C5, 99 atom % 13C, 97% (CP) CAS 881835-86-5 PubChem CID 46782950
[13CH3][13C](=O)[13CH2][13C](=O)[13CH2]CC(=O)O -
5-Methoxy-2-[(S)-[(4-methoxy-3,5-dimethyl-2-pyridinyl) methyl]sulfinyl]-1H-benzimidazole sodium salt CAS 161796-78-7 PubChem CID 46853837
COc1ccc2nc([S@@](=O)Cc3ncc(C)c(OC)c3C)[n-]c2c1.[Na+] -
Fc1ccccc1SC(F)(F)F -
5-[[4-[(2,3-dimethylindazol-6-yl)-(trideuterio(113C)methyl)amino]pyrimidin-2-yl]amino]-2-methylbenzenesulfonamide;hydrochloride CAS 1261398-44-0 PubChem CID 49849412
Cl.[2H][13C]([2H])([2H])N(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(S(N)(=O)=O)c2)n1 -
2-[(3S,4R,5S,6S,7E,9E,11E)-4,6-Dimethoxy-3,5,11-trimethyltrideca-7,9,11-trien-1-yl]-8-hydroxy-5,7-dimethoxy-3-methyl-4H-1-benzopyran-4-one CAS 94234-27-2 PubChem CID 49867661
C/C=C(C)/C=C/C=C/[C@H](OC)[C@@H](C)[C@H](OC)[C@@H](C)CCc1oc2c(O)c(OC)cc(OC)c2c(=O)c1C -
1H-Imidazole-1-carboxylicacid, 4-(2-aminoethyl)-, 1,1-dimethylethyl ester CAS 186700-06-1 PubChem CID 53249380
CC(C)(C)OC(=O)n1cnc(CCN)c1 -
C[Se]CC(=O)C(=O)O -
1H-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-2-((1-(phenylmethyl)-4-piperidinyl)methylene)-, (2E)- CAS 120014-07-5 PubChem CID 53394849
COc1cc2c(cc1OC)C(=O)C(=CC1CCN(Cc3ccccc3)CC1)C2 -
2-[2-[2-[2-[2-[2-(2-Aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylcarbamic acid tert-butyl ester CAS 1091627-77-8 PubChem CID 53401069
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCCOCCN -
Leucocrystal Violet D6; Benzenamine, 4,4'-[[4-[di(methyl-d3)amino]phenyl]methylene]bis[N,N-dimethyl- CAS 1173023-92-1 PubChem CID 53495991
[2H]C([2H])([2H])N(c1ccc(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)cc1)C([2H])([2H])[2H] -
1-Piperidineacetic acid, 3-(carboxymethylene)-alpha-(2-chlorophenyl)-4-mercapto-, 1-methyl ester, (alphaS)- CAS 767612-34-0 PubChem CID 53744301
COC(=O)C(c1ccccc1Cl)N1CCC(S)C(=CC(=O)O)C1