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Search results for: '801-999-3,848-737-4'
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CCT245737, Inhibitor of checkpoint kinase 1;Inhibitor of checkpoint kinase 2
Cas Number: 1489389-18-5Formula: C16H16F3N7OMolecular weight: 379.34Synonyms: CCT245737|1489389-18-5|(R)-5-((4-((morpholin-2-ylmethyl)amino)-5-(trifluoromethyl)pyridin-2-yl)amino...SMILES: C1COC(CN1)CNC2=CC(=NC=C2C(F)(F)F)NC3=NC=C(N=C3)C#NInChIKey: YBYYWUUUGCNAHQ-LLVKDONJSA-NInChI: InChI=1S/C16H16F3N7O/c17-16(18,19)12-8-25-14(26-15-9-22-10(4-20)5-24-15)3-13(12)23-7-11-6-21-1-2-27-11/h3,5,8-9,11,21H,1-2,6-7H2,(H2,23,24,25,26)/t11-/m1/s1
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JTC-801
Cas Number: 244218-51-7Formula: C26H25N3O2·HClMolecular weight: 447.96Synonyms: JTC801 | JTC-801 | SMR004702995 | JTC 801 | N-(4-amino-2-methyl-6-quinolyl)-2-[(4-ethylphenoxy)methy...SMILES: CCC1=CC=C(C=C1)OCC2=CC=CC=C2C(=O)NC3=CC4=C(C=C(N=C4C=C3)C)N.ClInChIKey: NQLIYKXNAXKMBL-UHFFFAOYSA-NInChI: InChI=1S/C26H25N3O2.ClH/c1-3-18-8-11-21(12-9-18)31-16-19-6-4-5-7-22(19)26(30)29-20-10-13-25-23(15-20)24(27)14-17(2)28-25;/h4-15H,3,16H2,1-2H3,(H2,27,28)(H,29,30);1H
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5-Dibenzosuberenone
Cas Number: 2222-33-5Formula: C15H10OMolecular weight: 206.24Synonyms: NSC 86151 | 5H-Dibenzo[a,d]cycloheptenone | FT-0602562 | Dibenzo[b,f]cyclohepten-1-one | MFCD0000358...SMILES: C1=CC=C2C(=C1)C=CC3=CC=CC=C3C2=OInChIKey: SNVTZAIYUGUKNI-UHFFFAOYSA-NInChI: InChI=1S/C15H10O/c16-15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)15/h1-10H
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Posenacaftor sodium
Cas Number: 2095064-06-3Formula: C27H26NNaO5Molecular weight: 467.49Synonyms: PTI-801 (sodium) | SCHEMBL20526947 | Posenacaftor (sodium) | 4-Quinolinecarboxylic acid, 8-methyl-2-...SMILES: CC1=C2C(=C(C=C1)OC(C)C3CCOCC3)C(=CC(=N2)C4=C(C5=CC=CC=C5O4)C)C(=O)[O-].[Na+]InChIKey: FIMNRWQYZVDFTK-UNTBIKODSA-MInChI: InChI=1S/C27H27NO5.Na/c1-15-8-9-23(32-17(3)18-10-12-31-13-11-18)24-20(27(29)30)14-21(28-25(15)24)26-16(2)19-6-4-5-7-22(19)33-26;/h4-9,14,17-18H,10-13H2,1-3H3,(H,29,30);/q;+1/p-1/t17-;/m1./s1
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(+)-MK 801 Maleate
Cas Number: 77086-22-7 EC Number: 278-614-5Formula: C16H15N · C4H4O4Molecular weight: 337.37Synonyms: DIZOCILPINE MALEATE [MART.] | DTXSID2045785 | SR-01000075457-1 | (+)-MK 801 (Maleate) | SCHEMBL12277...SMILES: CC12C3=CC=CC=C3CC(N1)C4=CC=CC=C24.C(=CC(=O)O)C(=O)OInChIKey: QLTXKCWMEZIHBJ-PJGJYSAQSA-NInChI: InChI=1S/C16H15N.C4H4O4/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16;5-3(6)1-2-4(7)8/h2-9,15,17H,10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-,16+;/m1./s1
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Oxypeucedanin
Cas Number: 737-52-0Formula: C16H14O5Molecular weight: 286.28Synonyms: Oxypeucedanin|737-52-0|4-[(3,3-dimethyloxiran-2-yl)methoxy]furo[3,2-g]chromen-7-one|(RS)-Oxypeucedan...SMILES: CC1(C(O1)COC2=C3C=CC(=O)OC3=CC4=C2C=CO4)CInChIKey: QTAGQHZOLRFCBU-UHFFFAOYSA-NInChI: InChI=1S/C16H14O5/c1-16(2)13(21-16)8-19-15-9-3-4-14(17)20-12(9)7-11-10(15)5-6-18-11/h3-7,13H,8H2,1-2H3
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Etifoxine(HOE 36-801), GABA-A receptor; anion channel antagonist
Cas Number: 21715-46-8Formula: C17H17ClN2OMolecular weight: 300.78Synonyms: MRF-0000029 | Etifoxine [INN:BAN:DCF] | SR-01000945088-1 | BRN 0548223 | Etifoxin | UNII-X24X82MX4X ...SMILES: CCN=C1NC2=C(C=C(C=C2)Cl)C(O1)(C)C3=CC=CC=C3InChIKey: IBYCYJFUEJQSMK-UHFFFAOYSA-NInChI: InChI=1S/C17H17ClN2O/c1-3-19-16-20-15-10-9-13(18)11-14(15)17(2,21-16)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3,(H,19,20)
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JTC-801, Antagonist of NOP receptor
Cas Number: 244218-93-7Synonyms: JTC-801 free base|244218-93-7|N-(4-amino-2-methylquinolin-6-yl)-2-((4-ethylphenoxy)methyl)benzamide|...SMILES: CCc1ccc(cc1)OCc1ccccc1C(=O)Nc1ccc2c(c1)c(N)cc(n2)CInChIKey: VTGBZWHPJFMTKS-UHFFFAOYSA-NInChI: InChI=1S/C26H25N3O2/c1-3-18-8-11-21(12-9-18)31-16-19-6-4-5-7-22(19)26(30)29-20-10-13-25-23(15-20)24(27)14-17(2)28-25/h4-15H,3,16H2,1-2H3,(H2,27,28)(H,29,30)
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Ethyl dithioacetate
Formula: C4H8S2Molecular weight: 120.24Synonyms: 2-CHLOROBENZOICACIDVINYLESTER | CH3C(S)SC2H5 | Ethyl ethanedithioate | ethanedithioic acid ethyl est...SMILES: CCSC(=S)CInChIKey: KCOPWUJJPSTRIZ-UHFFFAOYSA-NInChI: InChI=1S/C4H8S2/c1-3-6-4(2)5/h3H2,1-2H3
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1,2-Pentadiene
Cas Number: 591-95-7Formula: C5H8Molecular weight: 68.12Synonyms: EINECS 209-737-4 | InChI=1/C5H8/c1-3-5-4-2/h5H,1,4H2,2H | T72673 | 1,2-PENTADIENE | MFCD00039943 | D...SMILES: CCC=C=CInChIKey: LVMTVPFRTKXRPH-UHFFFAOYSA-NInChI: InChI=1S/C5H8/c1-3-5-4-2/h5H,1,4H2,2H3
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4-Methylvaleryl Chloride
Cas Number: 38136-29-7Formula: C6H11ClOMolecular weight: 134.6Synonyms: EINECS 253-801-4 | EN300-69079 | M2287 | BS-23268 | DTXSID0068072 | 4-Methylvaleryl chloride | Isoca...SMILES: CC(C)CCC(=O)ClInChIKey: SVWCVXFHTHCJJB-UHFFFAOYSA-NInChI: InChI=1S/C6H11ClO/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3
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Quinethazone, Thiazide-sensitive sodium-chloride cotransporter inhibitor
Cas Number: 73-49-4Formula: C10H12ClN3O3SMolecular weight: 289.74Synonyms: AC8883 | Chinetazone | QUINETHAZONE [INN] | 2-Ethyl-7-chloro-1,2,3,4-tetrahydro-4-oxochinazolin-6-su...SMILES: CCC1NC2=CC(=C(C=C2C(=O)N1)S(=O)(=O)N)ClInChIKey: AGMMTXLNIQSRCG-UHFFFAOYSA-NInChI: InChI=1S/C10H12ClN3O3S/c1-2-9-13-7-4-6(11)8(18(12,16)17)3-5(7)10(15)14-9/h3-4,9,13H,2H2,1H3,(H,14,15)(H2,12,16,17)
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di(pyridin-4-yl)amine
Cas Number: 1915-42-0Formula: C10H9N3Molecular weight: 171.203Synonyms: AO-801/40151488 | N-(4-Pyridinyl)-4-pyridinamine | AS-60097 | dipyridin-4-ylamine | D95279 | dcbpa |...SMILES: C1=CN=CC=C1NC2=CC=NC=C2InChIKey: KDWIKPVYQSPYIX-UHFFFAOYSA-NInChI: InChI=1S/C10H9N3/c1-5-11-6-2-9(1)13-10-3-7-12-8-4-10/h1-8H,(H,11,12,13)
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4-Methoxysalicylic Acid
Formula: C8H8O4Molecular weight: 168.15Synonyms: 4-Methoxysalicylic acid|2-Hydroxy-4-methoxybenzoic acid|2237-36-7|2-hydroxy-4-methoxy-benzoic acid|2...SMILES: COC1=CC(=C(C=C1)C(=O)O)OInChIKey: MRIXVKKOHPQOFK-UHFFFAOYSA-NInChI: InChI=1S/C8H8O4/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4,9H,1H3,(H,10,11)
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3-Methoxysalicylic Acid Methyl Ester
Cas Number: 6342-70-7Formula: C9H10O4Molecular weight: 182.18Synonyms: DTXSID30212836 | M2167 | SY002388 | AMY18434 | MFCD00239511 | cyclopropylmethyl-(4-methoxy-phenyl)-a...SMILES: COC1=CC=CC(=C1O)C(=O)OCInChIKey: BWRCJLJJIXYLNV-UHFFFAOYSA-NInChI: InChI=1S/C9H10O4/c1-12-7-5-3-4-6(8(7)10)9(11)13-2/h3-5,10H,1-2H3
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4-Aminopyrene
Cas Number: 17075-03-5Formula: C16H11NMolecular weight: 217.27Synonyms: pyren-4-amine | SB79471 | 4-Pyrenamine | DTXSID40168936 | AKOS015854635 | AO-801/41077362 | AYBSKADM...SMILES: C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)NInChIKey: AYBSKADMMKVOIV-UHFFFAOYSA-NInChI: InChI=1S/C16H11N/c17-14-9-12-5-1-3-10-7-8-11-4-2-6-13(14)16(11)15(10)12/h1-9H,17H2
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4-(Trifluoromethyl)benzoic acid
Formula: C8H5F3O2Molecular weight: 190.12Synonyms: Enamine_005626 | SCHEMBL78879 | 4-(Trifluoromethyl)benzoic acid, 98% | AKOS000118809 | BS-4038 | AO-...SMILES: C1=CC(=CC=C1C(=O)O)C(F)(F)FInChIKey: SWKPKONEIZGROQ-UHFFFAOYSA-NInChI: InChI=1S/C8H5F3O2/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13)
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4-Methoxy-o-phenylenediamine dihydrochloride
Cas Number: 59548-39-9 EC Number: 261-801-0Formula: C7H12Cl2N2OMolecular weight: 211.09Synonyms: 4-methoxy-l,2-phenylene diamine dihydrochloride | EINECS 261-801-0 | [2-amino-4-(methyloxy)phenyl]am...SMILES: COC1=CC(=C(C=C1)N)N.Cl.ClInChIKey: SXCHMHOBHJOXGC-UHFFFAOYSA-NInChI: InChI=1S/C7H10N2O.2ClH/c1-10-5-2-3-6(8)7(9)4-5;;/h2-4H,8-9H2,1H3;2*1H
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4-Methyl-2-phenylpyridine
Cas Number: 3475-21-6Formula: C12H11NMolecular weight: 169.22Synonyms: F52194 | AO-801/41077420 | FT-0634873 | DS-18129 | 2-Phenyl-4-picoline | 4-Methyl-2-phenylpyridine |...SMILES: CC1=CC(=NC=C1)C2=CC=CC=C2InChIKey: WWMRJCUZPJJWBC-UHFFFAOYSA-NInChI: InChI=1S/C12H11N/c1-10-7-8-13-12(9-10)11-5-3-2-4-6-11/h2-9H,1H3
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Pitofenone Hydrochloride
Cas Number: 1248-42-6Formula: C22H25NO4.HClMolecular weight: 403.9Synonyms: Methyl 2-(4-(2-piperidinoethoxy)benzoyl)benzoate hydrochloride | AKOS037515594 | CAS-1248-42-6 | Bar...SMILES: COC(=O)C1=CC=CC=C1C(=O)C2=CC=C(C=C2)OCCN3CCCCC3.ClInChIKey: ZRFIFDFEDPJBII-UHFFFAOYSA-NInChI: InChI=1S/C22H25NO4.ClH/c1-26-22(25)20-8-4-3-7-19(20)21(24)17-9-11-18(12-10-17)27-16-15-23-13-5-2-6-14-23;/h3-4,7-12H,2,5-6,13-16H2,1H3;1H
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Magnesium tungstate
Cas Number: 13573-11-0Formula: MgWO4Molecular weight: 272.16Synonyms: Magnesium tungsten oxide (MgWO4) | Magnesium wolframate, of a kind used as a luminophore | EINECS 23...SMILES: [O-][W](=O)(=O)[O-].[Mg+2]InChIKey: DJZHPOJZOWHJPP-UHFFFAOYSA-NInChI: InChI=1S/Mg.4O.W/q+2;;;2*-1;
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Clozapine, Dopamine D2 receptor antagonist
Cas Number: 5786-21-0Formula: C18H19ClN4Molecular weight: 326.82Synonyms: Clozapine (JAN/USP/INN) | HSDB 6478 | Prestwick1_000350 | Clozapine (Clozaril) | Clozapina [INN-Span...SMILES: CN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)NC4=CC=CC=C42InChIKey: QZUDBNBUXVUHMW-UHFFFAOYSA-NInChI: InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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5-Hydroxy-2-nitrobenzoic Acid
Cas Number: 610-37-7Formula: C7H5NO5Molecular weight: 183.12Synonyms: AKOS009157631 | 3-carboxy-4-nitrophenol;2-Nitro-5-hydroxybenzoic acid | 5-Hydroxy-2-Nitro Benzoic Ac...SMILES: C1=CC(=C(C=C1O)C(=O)O)[N+](=O)[O-]InChIKey: BUHKQTKKZAXSMH-UHFFFAOYSA-NInChI: InChI=1S/C7H5NO5/c9-4-1-2-6(8(12)13)5(3-4)7(10)11/h1-3,9H,(H,10,11)
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6-Methylpyridine-2-carboxylic acid
Formula: C7H7NO2Molecular weight: 137.14Synonyms: 6-methyl-2-picolinic acid | EINECS 213-287-4 | AO-801/41077373 | EN300-28863 | BBL023748 | FG-0452 |...SMILES: CC1=NC(=CC=C1)C(=O)OInChIKey: LTUUGSGSUZRPRV-UHFFFAOYSA-NInChI: InChI=1S/C7H7NO2/c1-5-3-2-4-6(8-5)7(9)10/h2-4H,1H3,(H,9,10)
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