Compound Search
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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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2-{4-[4-(1H-Indol-3-yl)-butyl]-piperazin-1-yl}-quinoline; compound with (Z)-but-2-enedioic acid CAS 75410-85-4 PubChem CID 6447434
O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O.c1ccc2nc(N3CCN(CCCCc4c[nH]c5ccccc45)CC3)ccc2c1 -
N-[1-(4-Cyclopentyl-phenyl)-ethyl]-N-methyl-2-morpholin-4-yl-acetamide; compound with (Z)-but-2-enedioic CAS 80649-55-4 PubChem CID 6448064
CC(c1ccc(C2CCCC2)cc1)N(C)C(=O)CN1CCOCC1.O=C(O)/C=C/C(=O)O -
1-(4-Cyclopentyl-phenyl)-2-[4-(2-hydroxy-ethyl)-piperazin-1-yl]-ethanol; compound with (Z)-but-2-enedioic CAS 85690-03-5 PubChem CID 6448309
O=C(O)/C=C\C(=O)O.O=C(O)/C=C\C(=O)O.OCCN1CCN(CC(O)c2ccc(C3CCCC3)cc2)CC1 -
4-Phenoxy-2-(4-propyl-piperazin-1-yl)-quinazoline; compound with (E)-but-2-enedioic acid CAS 129112-69-2 PubChem CID 6449132
CCCN1CCN(c2nc(Oc3ccccc3)c3ccccc3n2)CC1.O=C(O)/C=C/C(=O)O -
4-Pentyloxy-2-(4-propyl-piperazin-1-yl)-quinazoline; compound with (E)-but-2-enedioic acid CAS 129664-04-6 PubChem CID 6449164
CCCCCOc1nc(N2CCN(CCC)CC2)nc2ccccc12.O=C(O)/C=C/C(=O)O -
4-Butylsulfanyl-2-(4-methyl-piperazin-1-yl)-quinazoline; compound with (E)-but-2-enedioic acid CAS 129664-13-7 PubChem CID 6449172
CCCCSc1nc(N2CCN(C)CC2)nc2ccccc12.CCCCSc1nc(N2CCN(C)CC2)nc2ccccc12.O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O -
4-Hexylsulfanyl-2-(4-methyl-piperazin-1-yl)-quinazoline; compound with (E)-but-2-enedioic acid CAS 129664-15-9 PubChem CID 6449174
CCCCCCSc1nc(N2CCN(C)CC2)nc2ccccc12.O=C(O)/C=C/C(=O)O -
2-[4-(2-Methyl-allyl)-piperazin-1-yl]-4-pentyloxy-quinazoline; compound with (E)-but-2-enedioic acid CAS 129664-22-8 PubChem CID 6449179
C=C(C)CN1CCN(c2nc(OCCCCC)c3ccccc3n2)CC1.O=C(O)/C=C/C(=O)O -
(6R-(6alpha,7beta(R*)))-7-((Amino(4-hydroxyphenyl)acetyl)amino)-8-oxo-3-((1H-1,2,3-triazol-4-ylthio)methyl CAS 59139-54-7 PubChem CID 6453763
CO.NC(C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3cn[nH]n3)CS[C@H]12)c1ccc(O)cc1 -
5-(4-(Dimethylamino)benzylidene)-2-thioxo-4-imidazolidinone compound with piperidine (1:1) PubChem CID 6477908
C1CCNCC1.CN(C)c1ccc(/C=C2/NC(=S)NC2=O)cc1 -
2H-Thieno[3,2-e]-1,2-thiazine-6-sulfonamide, 4-(ethylamino)-3,4-dihydro-2-(3-methoxypropyl)-, 1,1-dioxide CAS 154127-19-2 PubChem CID 6604454
CCN[C@@H]1CN(CCCOC)S(=O)(=O)c2sc(S(N)(=O)=O)cc21 -
N-(4-methoxyphenyl)-2-[2-(1,3-thiazol-4-yl)-1H-1,3-benzodiazol-1-yl]acetamide, Compound C PubChem CID 6618978
COc1ccc(NC(=O)Cn2c(-c3cscn3)nc3ccccc32)cc1 -
4-[(E)-2-(Allyl-ethoxycarbonylmethyl-carbamoyl)-propenyl]-benzoic acid 4-carbamimidoyl-phenyl ester; PubChem CID 6913584
C=CCN(CC(=O)OCC)C(=O)/C(C)=C/c1ccc(C(=O)Oc2ccc(C(=N)N)cc2)cc1 -
N-{Amino-[N'-(4-trifluoromethyl-benzylidene)-hydrazino]-methyl}-hydroxylamine compound with toluene-4 PubChem CID 9570010
Cc1ccc(S(=O)(=O)O)cc1.N/C(=N\N=C\c1ccc(C(F)(F)F)cc1)NO -
thiocyanic acid compound with (E)-2-(4-(3,5-dimethyl-1H-pyrazol-4-yl)butan-2-ylidene)hydrazine-1-carbothioamide CAS 10514-39-3 PubChem CID 9570274
CC1=C(CC/C(C)=N/NC(N)=S)[NH+](C)C=N1.N#C[S-] -
4-[2-(1-Cyclopropylmethyl-piperidin-4-yl)-acetyl]-benzonitrile; compound with but-2-enedioic acid PubChem CID 9795762
N#Cc1ccc(C(=O)CC2CCN(CC3CC3)CC2)cc1 -
(S)-3-{2-[(R)-3-(4-Carbamimidoyl-phenyl)-4,5-dihydro-isoxazol-5-yl]-acetylamino}-2-(3,5-dimethyl-isoxazole PubChem CID 9812185
Cc1noc(C)c1S(=O)(=O)N[C@@H](CNC(=O)C[C@H]1CC(c2ccc(C(=N)N)cc2)=NO1)C(=O)O -
[3-(3,4-Dimethoxy-phenyl)-3-(2-{4-[1-(4-fluoro-benzyl)-1H-benzoimidazole-2-carbonyl]-piperidin-1-yl}- PubChem CID 9832306
CCOc1cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccc(F)cc4)CC3)(c3ccc(OC)c(OC)c3)C2)cc(OCC)c1OCC -
4-(2-Carbamimidoyl-1,2,3,4-tetrahydro-isoquinolin-7-yloxymethyl)-3,4,5,6-tetrahydro-2H-[1,4'''']bipyridinyl CAS 247131-06-2 PubChem CID 9844392
N=C(N)N1CCc2ccc(OCC3(C(=O)O)CCN(c4ccncc4)CC3)cc2C1 -
(S)-1-(4-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethyl}-piperazin-1-yl)-2-phenyl-propan-2-ol; compound with PubChem CID 9847375
C[C@@](O)(CN1CCN(CCOC(c2ccc(F)cc2)c2ccc(F)cc2)CC1)c1ccccc1