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基于 PubChem CID 索引，支持名称 / 同义词 / CAS / SMILES 检索。
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{[(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-{[(2S,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]oxy}-3-hydroxyoxolan-2-yl]methoxy}phosphonic acid CAS 15720-01-1 PubChem CID 3080702
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O -
Chlorotitanium(IV) triisopropoxide, Titanium(IV) chloride triisopropoxide CAS 20717-86-6 PubChem CID 3084342
CC(C)[O-].CC(C)[O-].CC(C)[O-].[Cl-].[Ti+4] -
2-(2,4-dichlorophenoxy)-N-(3-cyano(4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl))pr opanamide PubChem CID 3117546
CC(Oc1ccc(Cl)cc1Cl)C(=O)Nc1sc2c(c1C#N)CCCC2 -
N-(4-methyl-3-nitrophenyl)-2-[[(2E)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]sulfanyl]propanamide PubChem CID 3125719
Cc1ccc(NC(=O)C(C)Sc2nnc(-c3ccccc3O)o2)cc1[N+](=O)[O-] -
7-(2,3-dihydroxypropyl)-6-hydroxy-3-methyl-8-[(2-phenylethyl)amino]-3,7-dihydro-2H-purin-2-one CAS 335403-81-1 PubChem CID 3141430
Cn1c(=O)[nH]c(=O)c2c1nc(NCCc1ccccc1)n2CC(O)CO -
2-(5-methyl(10-hydro-1,2,4-triazolo[4,3-a]quinolinylthio))-N-(4-nitrophenyl)pr opanamide PubChem CID 3143151
Cc1cc2nnc(SC(C)C(=O)Nc3ccc([N+](=O)[O-])cc3)n2c2ccccc12 -
6-amino-4-(5-bromothiophen-2-yl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS 315246-48-1 PubChem CID 3156357
CCCc1[nH]nc2c1C(c1ccc(Br)s1)C(C#N)=C(N)O2 -
2-(4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl)-N-(1-hydroxy-4,4-dimethylpentan-3-yl)-2-methylpropanamide PubChem CID 3319043
CC(C)(C(=O)NC(CCO)C(C)(C)C)C1=NC(C(C)(C)C)CO1 -
2-{[3-(2,3-diphenyl-1H-benzo[g]indol-1-yl)-2-hydroxypropyl]amino}-2-(hydroxymethyl)propane-1,3-diol PubChem CID 3566025
OCC(CO)(CO)NCC(O)Cn1c(-c2ccccc2)c(-c2ccccc2)c2ccc3ccccc3c21 -
COC(=O)C(COC(C)(C)C)NC(=O)C(NC(=O)C(CSCNC(C)=O)NC(=O)OC(C)(C)c1ccc(-c2ccccc2)cc1)C(C)OC(C)(C)C -
N-{1-[2-(4-tert-butylcyclohexylidene)hydrazinyl]-1-oxopropan-2-yl}-N-phenylmethanesulfonamide (non-preferred name) PubChem CID 3900890
CC(C(=O)NN=C1CCC(C(C)(C)C)CC1)N(c1ccccc1)S(C)(=O)=O -
1-[(3-methyl-4-phenylpyridin-2-yl)methylideneamino]-3-prop-2-enylthiourea CAS 76609-58-0 PubChem CID 4024207
C=CCNC(=S)NN=Cc1nccc(-c2ccccc2)c1C -
2-[(1-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide PubChem CID 4153794
CCCc1nc(SCC(=O)Nc2cccc(C(F)(F)F)c2)nn1N -
methyl 4-(2-hydroxy-3-piperidin-1-ylpropyl)-2,3-dimethylfuro[3,2-b]pyrrole-5-carboxylate PubChem CID 4191315
COC(=O)c1cc2oc(C)c(C)c2n1CC(O)CN1CCCCC1 -
3-[4-chloro-5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(1,3-thiazol-2-yl)propanamide PubChem CID 4770504
O=C(CCn1nc(C(F)(F)F)c(Cl)c1C1CC1)Nc1nccs1 -
amino-p-[2-(3,5-dioxo-4-azatricyclo[5.2.1.0(2),]dec-8-en-4-yl)propionylamino]phenyl(oxo)-lambda-sulfaniumolate CAS 1042743-61-2 PubChem CID 4973984
CC(C(=O)Nc1ccc(S(N)(=O)=O)cc1)N1C(=O)C2C3C=CC(C3)C2C1=O -
(2E)-N-[(2-chlorophenyl)methyl]-3-(5-nitro(2-furyl))-2-(phenylcarbonylamino)pr op-2-enamide PubChem CID 5338175
O=C(NCc1ccccc1Cl)/C(=C\c1ccc([N+](=O)[O-])o1)NC(=O)c1ccccc1 -
1,1-Bis[(2E)-3-chloroprop-2-en-1-yl]-2-(oxo-lambda~4~-sulfanylidene)hydrazine CAS 20582-08-5 PubChem CID 5380375
O=S=NN(C/C=C/Cl)C/C=C/Cl -
1,1-Bis[(2Z)-3-chloroprop-2-en-1-yl]-2-(oxo-lambda~4~-sulfanylidene)hydrazine CAS 20582-07-4 PubChem CID 5380376
O=S=NN(C/C=C\Cl)C/C=C\Cl -
7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione PubChem CID 5758605
C/C(=N/Nc1nc2c(c(=O)[nH]c(=O)n2C)n1CC(O)COc1ccccc1)c1ccccc1