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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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ethyl 2,2,3,3-tetradeuterio-3-[methyl-(1,1,2,2-tetradeuterio-3-ethoxy-3-oxopropyl)amino]propanoate CAS 6315-60-2 PubChem CID 228362
CCOC(=O)CCN(C)CCC(=O)OCC -
Piperazine,1-(4-chlorophenyl)-4-[3-[4-(2-methylphenyl)-1-piperazinyl]propyl]- (9CI) CAS 6320-27-0 PubChem CID 233362
Cc1ccccc1N1CCN(CCCN2CCN(c3ccc(Cl)cc3)CC2)CC1 -
2-Propen-1-one,3-(1,3-benzodioxol-5-yl)-1-(2-hydroxy-4-methoxyphenyl)- CAS 36685-65-1 PubChem CID 308423
COc1ccc(C(=O)C=Cc2ccc3c(c2)OCO3)c(O)c1 -
12-(propan-2-yl)-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one PubChem CID 465257
CCCN1Cc2cccc3[nH]c(=O)n(c23)C(C(C)C)C1 -
CCCC(C(C)=O)C(O)CC -
7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,3-dimethyl-8-(phenylamino)-2,3,6,7-tetrahydro-1H-purine-2,6-dione CAS 505081-13-0 PubChem CID 646488
COc1ccc(OCC(O)Cn2c(Nc3ccccc3)nc3c2c(=O)n(C)c(=O)n3C)cc1 -
ethyl 2-amino-1-[3-(dimethylamino)propyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate CAS 30119-33-6 PubChem CID 699551
CCOC(=O)c1c(N)n(CCCN(C)C)c2nc3ccccc3nc12 -
3-[3-[(5Z)-4-oxo-5-[(E)-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid PubChem CID 1321269
O=C(CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)Nc1cccc(C(=O)O)c1 -
(2E)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one PubChem CID 1321774
COc1cc(/C=C/C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)cc(OC)c1OC -
4-[3-[(5Z)-4-oxo-5-[(E)-3-phenylprop-2-enylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid PubChem CID 1321802
O=C(CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)Nc1ccc(C(=O)O)cc1 -
3-({5-methyl-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl}amino)propan-1-ol PubChem CID 2059181
Cc1nc(NCCCO)c2c3c(sc2n1)CCCC3 -
diethyl 5-[2-(1,3-dimethoxy-1,3-dioxopropan-2-ylidene)hydrazinyl]-3-methylthiophene-2,4-dicarboxylate PubChem CID 2132994
CCOC(=O)c1sc(NN=C(C(=O)OC)C(=O)OC)c(C(=O)OCC)c1C -
methyl 3-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate CAS 303027-69-2 PubChem CID 2277399
COC(=O)CCN1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S -
4,5,6,7-Tetrahydro-6-methyl-N-1-naphthalenyl-2-[(1-oxopropyl)amino]benzo[b]thiophene-3-carboxamide CAS 312948-99-5 PubChem CID 2861613
CCC(=O)Nc1sc2c(c1C(=O)Nc1cccc3ccccc13)CCC(C)C2 -
6-amino-4-(2-bromophenyl)-3-propyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS 315246-33-4 PubChem CID 2879168
CCCc1[nH]nc2c1C(c1ccccc1Br)C(C#N)=C(N)O2 -
6-amino-4-(5-methylthiophen-2-yl)-3-propyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile PubChem CID 2908683
CCCc1[nH]nc2c1C(c1ccc(C)s1)C(C#N)=C(N)O2 -
N-(4-BROMO-2-CHLOROPHENYL)-3-{3,5-DIOXO-4-AZATRICYCLO[5.2.1.0(2),?]DECAN-4-YL}PROPANAMIDE PubChem CID 2950054
O=C(CCN1C(=O)C2C3CCC(C3)C2C1=O)Nc1ccc(Br)cc1Cl -
N-(4-BROMO-3-CHLOROPHENYL)-2-{3,5-DIOXO-4-AZATRICYCLO[5.2.1.0(2),?]DECAN-4-YL}PROPANAMIDE PubChem CID 2950811
CC(C(=O)Nc1ccc(Br)c(Cl)c1)N1C(=O)C2C3CCC(C3)C2C1=O -
7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione CAS 316358-60-8 PubChem CID 3109650
CCCCCCCCCSc1nc2c(c(=O)[nH]c(=O)n2C)n1CC(O)COc1ccc(Cl)cc1 -
ethyl 2-[(3-methyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]butanoate CAS 331751-75-8 PubChem CID 3111686
CCCn1c(SC(CC)C(=O)OCC)nc2c1c(=O)[nH]c(=O)n2C