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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15-Benzyl-15-azapentacyclo[6.6.5.01,18.02,7.09,14]nonadeca-2,4,6,9,11,13-hexaen-17-one CAS 89014-24-4 PubChem CID 163566
O=C1CN(Cc2ccccc2)C23c4ccccc4C(CC12)c1ccccc13 -
2-[4-(1,2-Diphenylethenyl)phenoxy]-N,N-diethyl-ethanamine; 2-[p-(1,2-Diphenylvinyl)phenoxy]-triethylamine; E.I.P.W. 103; a-[4-(2-Diethylaminoethoxy)phenyl]stilbene CAS 19957-52-9 PubChem CID 192969
CCN(CC)CCOc1ccc(C(=Cc2ccccc2)c2ccccc2)cc1 -
Carbamic acid, [(1S)-2-[[(3-bromo-4,5-dihydro-5-isoxazolyl)methyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxoethyl]-, phenylmethyl ester (9CI) CAS 744198-17-2 PubChem CID 644315
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC1CC(Br)=NO1)OCc1ccccc1 -
Cc1ccc(NC(=O)NCc2cccnc2)cc1 -
BAY 11-7082; (E)-3-[(4-Methylphenyl)sulfonyl]-2-propenenitrile; (E)-3-(p-Tolylsulfonyl)-acrylonitrile; BAY 11-7821; BAY 117821 CAS 19542-67-7 PubChem CID 5353431
Cc1ccc(S(=O)(=O)/C=C/C#N)cc1 -
9-Octadecenoic acid (9Z)-, compd. with N,N-diethylethanamine (1:1) CAS 10103-17-0 PubChem CID 6506386
CCCCCCCC/C=C/CCCCCCCC(=O)O.CCN(CC)CC -
(2R,3R,4R,5R)-2,5-bis({[(2E)-3-(3,5-dimethyl-1,2-oxazol-4-yl)prop-2-en-1-yl]oxy})-3,4-dihydroxy-N,N''-bis[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]hexanediamide PubChem CID 6539251
Cc1noc(C)c1/C=C/CO[C@@H](C(=O)N[C@H]1c2ccccc2C[C@H]1O)[C@H](O)[C@@H](O)[C@@H](OC/C=C/c1c(C)noc1C)C(=O)N[C@H]1c2ccccc2C[C@H]1O -
tert-butyl N-[(3S,6S,9R,13Z)-3-[(1S,3R)-3-(butylcarbamoyl)-1-hydroxy-3-methylpropyl]-6-methyl-5,8-dioxo-1-oxa-11-thia-4,7-diazacyclopentadec-13-en-9-yl]carbamate PubChem CID 11846139
CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H]1COC/C=C\CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)N1 -
O=C=Nc1cccc(C(F)(F)F)c1Cl -
1,1-dioxo-3-[(prop-2-yn-1-ylamino)methyl]-2-(propan-2-yl)-2H-1$l^{6},7,2-thieno[3,2-e][1,2]thiazine-6-sulfonamide PubChem CID 19434076
C#CCNCC1=Cc2cc(S(N)(=O)=O)sc2S(=O)(=O)N1C(C)C -
C=CCCCCCCCCC(=O)O.CCNCC -
P-[[1-hydroxy-6-[[[[5-hydroxy-6-(phenylazo)-7-sulpho-2-naphthyl]amino]carbonyl]amino]-3-sulpho-2-naphthyl]azo]benzoic acid, compound with 2,2',2''-nitrilotriethanol (1:3) CAS 93965-17-4 PubChem CID 44150888
O=C(Nc1ccc2c(c1)C=C(S(=O)(=O)O)/C(=N\Nc1ccc(C(=O)O)cc1)C2=O)Nc1ccc2c(c1)C=C(S(=O)(=O)O)/C(=N/Nc1ccccc1)C2=O.OCCN(CCO)CCO.OCCN(CCO)CCO.OCCN(CCO)CCO -
Ajmalan-17,21-diol, (17R,21.alpha.)-, compd. with dichloromethane (1:1) CAS 66121-34-4 PubChem CID 90684469
CC[C@H]1[C@@H]2C[C@H]3[C@@H]4N(C)c5ccccc5C45C[C@@H]([C@@H]2[C@H]5O)N3[C@@H]1O.ClCCl -
CCc1nccn1CCC(C#N)(c1ccccc1)c1ccccc1 -
diethyl 3-carbamoyl-1-(2- ((2S,4R)-2-(3-chloro-2- fluorobenzylcarbamoyl)-4- fluoropyrrolidin-1-yl)-2- oxoethyl)-1H-indazol-6- ylphosphonate PubChem CID 118322281
CCOP(=O)(OCC)c1ccc2c(C(N)=O)nn(CC(=O)N3C[C@H](F)C[C@H]3C(=O)NCc3cccc(Cl)c3F)c2c1 -
(R)-N-(1-acetyl-1H- indol-3-yl)-1-(2-(3- chloro-2- fluorophenyl)acetyl)- 4,4-difluoropyrrolidine- 2-carboxamide PubChem CID 118323368
CC(=O)n1cc(NC(=O)[C@H]2CC(F)(F)CN2C(=O)Cc2cccc(Cl)c2F)c2ccccc21 -
(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-6-aminohexanoic acid compound with 2,2,2-trifluoroacetic acid (1:1) CAS 195456-17-8 PubChem CID 122198339
CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](CCCCN)C(=O)O.O=C(O)C(F)(F)F -
2-chloro-N-[3-(1-hydroxy-1- methylethyl)-7-phenylimidazo[1,2- a]pyridin-8-yl]-5-(1-methyl-1H-pyrazol- 3-yl)-4-(trifluoromethyl)benzamide PubChem CID 122609279
Cn1ccc(-c2cc(C(=O)Nc3c(-c4ccccc4)ccn4c(C(C)(C)O)cnc34)c(Cl)cc2C(F)(F)F)n1 -
(S)-2-(tert-butoxy)-2-(4-(4,4-dimethylpiperidin-1-yl)-2,6- dimethyl-5-(2-(1-methyl-1H-benzo[d]imidazol-2-yl)-1,2,3,4- tetrahydroisoquinolin-6-yl)pyridin-3-yl)acetic acid PubChem CID 126574417
Cc1nc(C)c([C@H](OC(C)(C)C)C(=O)O)c(N2CCC(C)(C)CC2)c1-c1ccc2c(c1)CCN(c1nc3ccccc3n1C)C2 -
(R)-1-(3-(3-(4-(2,3- difluorophenoxy)phenyl)-1H- pyrazolo[4,3-c]pyridin-1-yl)piperidin-1- yl)prop-2-en-1-one PubChem CID 130248055
C=CC(=O)N1CCC[C@@H](n2nc(-c3ccc(Oc4cccc(F)c4F)cc3)c3cnccc32)C1