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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2-Cyclopentene-1-methanol, 4-(2,6-diamino-9H-purin-9-yl)-, (1S,4R)-; 2-Cyclopentene-1-methanol, 4-(2,6 CAS 124752-25-6 PubChem CID 130245
Nc1nc(N)c2ncn([C@H]3C=C[C@@H](CO)C3)c2n1 -
A (EP); Valsartan USP Related Compound A; Valsartan USP RC A; (2R)-3-Methyl-2-[pentanoyl[[2'-(1H-tetrazol CAS 137862-87-4 PubChem CID 5284633
CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1)[C@@H](C(=O)O)C(C)C -
7-[4-[4-(2,3-Dichlorophenyl)piperazin-1-yl]butoxy]quinolin-2(1H)-one; Dehydroaripiprazole; Aripiprazole CAS 129722-25-4 PubChem CID 10114519
O=c1ccc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2[nH]1 -
2(1H)-Quinolinone, 7-[4-[4-(2,3-dichlorophenyl)-1-oxido-1-piperazinyl]butoxy]-3,4-dihydro-; Aripiprazole CAS 573691-09-5 PubChem CID 10288582
O=C1CCc2ccc(OCCCC[N+]3([O-])CCN(c4cccc(Cl)c4Cl)CC3)cc2N1 -
1-(9H-Carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl](phenylmethyl)amino]-2-propanol; N-Benzyl Carvedilol CAS 72955-94-3 PubChem CID 11038364
COc1ccccc1OCCN(Cc1ccccc1)CC(O)COc1cccc2[nH]c3ccccc3c12 -
B (EP); Ciclopirox USP Related Compound B; Ciclopirox USP RC B; 6-Cyclohexyl-4-methyl-2H-pyran-2-one; CAS 14818-35-0 PubChem CID 19858323
Cc1cc(C2CCCCC2)oc(=O)c1 -
4-Diazo-4H-Imidazole-5-carboxamide; 5-Diazoimidazole-4-carboxamide; Temozolomide Related Compound A; CAS 7008-85-7 PubChem CID 53426585
[N-]=[N+]=C1N=CN=C1C(N)=O -
A (EP); Irbesartan USP Related Compound A; Irbesartan USP RC A; 1-(Pentanoylamino)-N-[[2'-(1H-tetrazol CAS 748812-53-5 PubChem CID 68617604
CCCCC(=O)NC1(C(=O)NCc2ccc(-c3ccccc3-c3nn[nH]n3)cc2)CCCC1 -
1-[[9-[2-Hydroxy-3-[[2-(2-methoxy-phenoxy)ethyl]amino]propyl]-9H-carbazol-4-yl]oxy]-3-[[2-(2-methoxyphenoxy CAS 1198090-73-1 PubChem CID 71312558
COc1ccccc1OCCNCC(O)COc1cccc2c1c1ccccc1n2CC(O)CNCCOc1ccccc1OC -
3'-N-[[4-(acetylamino)phenyl]sulfonyl]-3'-N-demethylazithromycin; Azithromycin Related Compound H (USP CAS 612069-30-4 PubChem CID 71312817
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)S(=O)(=O)c3ccc(NC(C)=O)cc3)[C@H]2O)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O -
Atorvastatin Related Compound E (USP); Atorvastatin Calcium Trihydrate Imp. CAS 1105067-88-6 PubChem CID 88078086
CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)[O-].CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@H](O)C[C@H](O)CC(=O)[O-].[Ca+2] -
A (EP); Sildenafil USP Related Compound A; Sildenafil USP RC A; 7H-Pyrazolo[4,3-d]pyrimidin-7-one, 5- CAS 1391053-95-4 PubChem CID 135565336
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1-c1nc2c(CC(C)C)nn(C)c2c(=O)[nH]1 -
B (EP); Benzothiadiazine USP Related Compound A; Benzothiadiazine USP RC A; 4-Amino-6-chlorobenzene-1,3 CAS 121-30-2 PubChem CID 67136
Nc1cc(Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O -
2-Oxazolidinone, 5-(aminomethyl)-3-[3-fluoro-4-(4-morpholinyl)phenyl]-, (5S)-; 2-Oxazolidinone, 5-(aminomethyl CAS 168828-90-8 PubChem CID 10780199
NC[C@H]1CN(c2ccc(N3CCOCC3)c(F)c2)C(=O)O1 -
(Z)-(2-Aminothiazol-4-yl)methoxyiminoacetic acid; (Z)-2-(2-Aminothiazol-4-yl)-2-methoxyiminoacetic acid CAS 65872-41-5 PubChem CID 5486924
CO/N=C(\C(=O)O)c1csc(N)n1 -
Benzenesulfonamide, N-[6-chloro-5-(2-methoxyphenoxy)[2,2'-bipyrimidin]-4-yl]-4-(1,1-dimethylethyl)-; CAS 150727-06-3 PubChem CID 11135160
COc1ccccc1Oc1c(Cl)nc(-c2ncccn2)nc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1 -
C (EP); Terazosin USP Related Compound A; Terazosin USP RC A; 6,7-Dimethoxy-2-(piperazin-1-yl)quinazolin CAS 60547-97-9 PubChem CID 616267
COc1cc2nc(N3CCNCC3)nc(N)c2cc1OC -
(R)-[3-(3-Fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl]methyl methanesulfonate; (5R)-3-[3-Fluoro-4 CAS 174649-09-3 PubChem CID 10643120
CS(=O)(=O)OC[C@H]1CN(c2ccc(N3CCOCC3)c(F)c2)C(=O)O1 -
(4S)-4-Cyclohexyl-1-[[hydroxy(4-phenylbutyl)phosphinyl]acetyl]-L-proline; trans-4-Cyclohexyl-1-[[hydroxy CAS 95399-71-6 PubChem CID 62956
O=C(O)[C@@H]1C[C@@H](C2CCCCC2)CN1C(=O)CP(=O)(O)CCCCc1ccccc1 -
6-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole Hydrochloride (1:1); 1,2-Benzisoxazole, 6-fluoro-3-(4-piperidinyl CAS 84163-13-3 PubChem CID 11334359
Cl.Fc1ccc2c(C3CCNCC3)noc2c1