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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(S)-3-{[2-(4-Carbamimidoyl-benzyloxy)-4-methyl-3-oxo-3,4-dihydro-2H-benzo[1,4]oxazine-7-carbonyl]-amino PubChem CID 11489885
CN1C(=O)C(OCc2ccc(C(=N)N)cc2)Oc2cc(C(=O)N[C@@H](CC(=O)O)c3ccccc3)ccc21 -
(S)-N-Methyl-3-(naphthalen-1-yloxy)-3-(thiophen-3-yl)propan-1-amine; USP Duloxetine Related Compound CAS 116817-27-7 PubChem CID 11855337
CNCCC(Oc1cccc2ccccc12)c1ccsc1 -
H (EP); 3-[3-Acetyl-4-[(2RS)-3-bromo-2-hydroxypropoxy]phenyl]-1,1-diethylurea; Bromhydrin Compound of CAS 85045-98-3 PubChem CID 12825778
CCN(CC)C(=O)Nc1ccc(OCC(O)CBr)c(C(C)=O)c1 -
2-CYANO-3-(2-HYDROXY-4,4-DIMETHYL-6-OXO-1-CYCLOHEXEN-1-YL)-3-(3-PYRIDINYL)PROPANETHIOAMIDE COMPOUND WITH PubChem CID 13677405
C1COCCN1.CC1(C)CC(=O)C(C(c2cccnc2)C(C#N)C(N)=S)=C(O)C1 -
3-((2E)-2-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3(2H)-yl)-1-propanesulfonic PubChem CID 14323590
CCN(CC)CC.CCN1C(=O)/C(=C2\Sc3ccccc3N2CCCS(=O)(=O)O)SC1=S -
(2-{2-[3-(3-butyl -7-dimethylamino-3-ethyl-4-hydroxy-1,1-dioxo-2,3,4,5-tetrahydro-1H-benzo[b]thiepin PubChem CID 18374598
CCCCC1(CC)CS(=O)(=O)c2ccc([NH+](C)C)cc2C(c2cccc(NCCOCCOCC(=O)O)c2)C1O.O=C([O-])C(F)(F)F -
5-Amino-2,4,6-triiodo-3-[N-(2-hydroxyethyl)aminocarbonyl]benzoic acid; 3-Amino-5-[[(2-hydroxyethyl)amino CAS 22871-58-5 PubChem CID 19777538
Nc1c(I)c(C(=O)O)c(I)c(C(=O)NCCO)c1I -
3-[3-chloro-4-(3-phenylpropoxy)phenyl]-2-methylpropanoic acid compound with cyclohexanamine (1:1) PubChem CID 24212939
CC(Cc1ccc(OCCCc2ccccc2)c(Cl)c1)C(=O)O.NC1CCCCC1 -
N-[3-[[2-Methoxy-4-[[[(3-methylphenyl)sulfonyl]amino]carbonyl]phenyl]methyl]-1-methyl-1H-indol-5-yl]carbamic CAS 1159195-69-3 PubChem CID 42633112
COc1cc(C(=O)NS(=O)(=O)c2cccc(C)c2)ccc1Cc1cn(C)c2ccc(NC(=O)OC3CCCC3)cc12 -
1-Butyl-5-(3-(1-butyl-5-cyano-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)allylidene)-1,2,5,6-tetrahydro CAS 69636-64-2 PubChem CID 44147403
CCCCN1C(=O)C(C#N)=C(C)/C(=C/C=C/c2c(C)c(C#N)c(=O)n(CCCC)c2O)C1=O.c1ccncc1 -
4-(4,5-Dihydro-4-(3-(5-hydroxy-3-methyl-1-(4-sulphophenyl)-1H-pyrazol-4-yl)allylidene)-3-methyl-5-oxo CAS 93858-58-3 PubChem CID 44147762
CC1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)/C1=C\C=C\c1c(C)[nH]n(-c2ccc(S(=O)(=O)O)cc2)c1=O.CCN(CC)CC -
3-Ethyl 4-(3-(hexahydro-1,3-dimethyl-2,4,6-trioxo-5-pyrimidinyl)allylidene)-4,5-dihydro-5-oxo-1-(4-sulphophenyl CAS 78902-53-1 PubChem CID 44149272
CCN(CC)CC.CCN(CC)CC.CCOC(=O)C1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)/C1=C\C=C\C1C(=O)N(C)C(=O)N(C)C1=O -
Phosphoric acid 6-(2-{4-[(S)-2-[(R)-2-amino-3-(1H-indol-2-yl)-propionylamino]-3-(1H-indol-3-yl)-propionylamino PubChem CID 44320147
N[C@H](Cc1cc2ccccc2[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCC(=O)NCC(=O)NCCCCCCOP(=O)(O)Oc1ccccc1Cl -
Phosphoric acid 6-(2-{4-[(R)-2-[(R)-2-amino-3-(1H-indol-2-yl)-propionylamino]-3-(1H-indol-3-yl)-propionylamino PubChem CID 44320320
N[C@H](Cc1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCCCC(=O)NCC(=O)NCCCCCCOP(=O)(O)Oc1ccccc1Cl -
Phosphoric acid 12-[(R)-2-((R)-2-amino-3-phenyl-propionylamino)-3-(1H-indol-3-yl)-propionylamino]-dodecyl PubChem CID 44320400
N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCCCCCCCCCCCCOP(=O)(O)Oc1ccccc1Cl -
Phosphoric acid 6-(2-{4-[(S)-2-[(S)-2-amino-3-(1H-indol-2-yl)-propionylamino]-3-(1H-indol-3-yl)-propionylamino PubChem CID 44320437
N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCC(=O)NCC(=O)NCCCCCCOP(=O)(O)Oc1ccccc1Cl -
Phosphoric acid 2-chloro-phenyl ester 2-(2-{2-[2-(2-{1-[3-(3-methyl-indol-1-yl)-propyl]-1H-indol-3-yl PubChem CID 44320451
Cc1cn(CCCn2cc(CC(=O)NCCOCCOCCOCCOP(=O)(O)Oc3ccccc3Cl)c3ccccc32)c2ccccc12 -
Phosphoric acid 2-chloro-phenyl ester 6-(2-{1-[3-(3-methyl-indol-1-yl)-propyl]-1H-indol-3-yl}-acetylamino PubChem CID 44320453
Cc1cn(CCCn2cc(CC(=O)NCCCCCCOP(=O)(O)Oc3ccccc3Cl)c3ccccc32)c2ccccc12 -
Phosphoric acid 2-chloro-phenyl ester 6-({1-[4-(2-{1-[3-(3-methyl-indol-1-yl)-propyl]-1H-indol-3-yl}- PubChem CID 44320507
Cc1cn(CCCn2cc(CC(=O)NCCCC(=O)N3CCCC3C(=O)NCCCCCCOP(=O)(O)Oc3ccccc3Cl)c3ccccc32)c2ccccc12 -
Phosphoric acid 12-[(R)-2-[(R)-2-amino-3-(1H-indol-2-yl)-propionylamino]-3-(1H-indol-3-yl)-propionylamino PubChem CID 44320612
N[C@H](Cc1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCCCCCCCCCCCCOP(=O)(O)Oc1ccccc1Cl