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Search results for: '881-285-6'
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Vorasidenib (AG-881), IDH1/IDH2 inhibitor
Cas Number: 1644545-52-7Formula: C14H13ClF6N6Molecular weight: 414.74Synonyms: 6-(6-chloropyridin-2-yl)-2-N,4-N-bis[(2R)-1,1,1-trifluoropropan-2-yl]-1,3,5-triazine-2,4-diamine | A...SMILES: CC(C(F)(F)F)NC1=NC(=NC(=N1)C2=NC(=CC=C2)Cl)NC(C)C(F)(F)FInChIKey: QCZAWDGAVJMPTA-RNFRBKRXSA-NInChI: InChI=1S/C14H13ClF6N6/c1-6(13(16,17)18)22-11-25-10(8-4-3-5-9(15)24-8)26-12(27-11)23-7(2)14(19,20)21/h3-7H,1-2H3,(H2,22,23,25,26,27)/t6-,7-/m1/s1
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Harpagoside
Cas Number: 19210-12-9(DMSO) EC Number: 242-881-6Formula: C24H30O11Molecular weight: 494.49Synonyms: Harpagoside|19210-12-9|E-harpagoside|UNII-8KGS1DC5ZU|8KGS1DC5ZU|EINECS 242-881-6|CHEBI:5625|[(1S,4aS...SMILES: CC1(CC(C2(C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O)OC(=O)C=CC4=CC=CC=C4InChIKey: KVRQGMOSZKPBNS-FMHLWDFHSA-NInChI: See more
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Pinacryptol yellow
Cas Number: 25910-85-4 EC Number: 247-336-6Formula: C21H22N2O7SMolecular weight: 446.47Synonyms: 8N5P6K2EGB | EN300-21680282 | (E)-6-Ethoxy-1-methyl-2-(3-nitrostyryl)quinolin-1-ium | 6-Ethoxy-1-met...SMILES: CCOC1=CC2=C(C=C1)[N+](=C(C=C2)C=CC3=CC(=CC=C3)[N+](=O)[O-])C.COS(=O)(=O)[O-]InChIKey: ZXQHSPWBYMLHLB-BXTVWIJMSA-MInChI: InChI=1S/C20H19N2O3.CH4O4S/c1-3-25-19-11-12-20-16(14-19)8-10-17(21(20)2)9-7-15-5-4-6-18(13-15)22(23)24;1-5-6(2,3)4/h4-14H,3H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1/b9-7+;
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2′,6′-Difluoropropiophenone
Cas Number: 85068-31-1Formula: C9H8F2OMolecular weight: 170.16Synonyms: MFCD00015506 | 2',6'-Difluoropropiophenone | 2,6-Difluoropropiophenone | EINECS 285-293-5 | FT-06106...SMILES: CCC(=O)C1=C(C=CC=C1F)FInChIKey: ISFKUAKHXQLAFN-UHFFFAOYSA-NInChI: InChI=1S/C9H8F2O/c1-2-8(12)9-6(10)4-3-5-7(9)11/h3-5H,2H2,1H3
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Dichlorophenylborane
Cas Number: 873-51-8Formula: C6H5BCl2Molecular weight: 158.82Synonyms: Borine, dichlorophenyl- | Phenylboron dibromide | D4367 | InChI=1/C6H5BCl2/c8-7(9)6-4-2-1-3-5-6/h1-5...SMILES: B(C1=CC=CC=C1)(Cl)ClInChIKey: NCQDQONETMHUMY-UHFFFAOYSA-NInChI: InChI=1S/C6H5BCl2/c8-7(9)6-4-2-1-3-5-6/h1-5H
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TC-E 5003
Cas Number: 17328-16-4Formula: C16H14Cl2N2O4SMolecular weight: 401.26Synonyms: N,N inverted exclamation mark -[Sulfonylbis(4,1-phenylene)]bis(2-chloroacetamide) | A921688 | 4-(2,2...SMILES: C1=CC(=CC=C1NC(=O)CCl)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CClInChIKey: SHRCVZJKZJGIHQ-UHFFFAOYSA-NInChI: InChI=1S/C16H14Cl2N2O4S/c17-9-15(21)19-11-1-5-13(6-2-11)25(23,24)14-7-3-12(4-8-14)20-16(22)10-18/h1-8H,9-10H2,(H,19,21)(H,20,22)
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3,5-Bis(trifluoromethyl)phenylacetic Acid
Cas Number: 85068-33-3Formula: C10H6F6O2Molecular weight: 272.15Synonyms: MFCD00009908 | PS-7275 | [3,5 -Bis-(trifluoromethyl)-phenyl]-acetic Acid | 3,5-bistrifluoromethylphe...SMILES: C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CC(=O)OInChIKey: PAWSKKHEEYTXSA-UHFFFAOYSA-NInChI: InChI=1S/C10H6F6O2/c11-9(12,13)6-1-5(3-8(17)18)2-7(4-6)10(14,15)16/h1-2,4H,3H2,(H,17,18)
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1,1,1-Trifluoro-n,n-dimethylmethanesulfonamide
Cas Number: 28048-17-1 EC Number: 881-285-6Formula: C3H6F3NO2SMolecular weight: 177.15SMILES: CN(C)S(=O)(=O)C(F)(F)FInChIKey: GSIWUFBWQIELGP-UHFFFAOYSA-NInChI: InChI=1S/C3H6F3NO2S/c1-7(2)10(8,9)3(4,5)6/h1-2H3
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1,2-Pentanediol
Cas Number: 5343-92-0Formula: CH3CH2CH2CH(OH)CH2OHMolecular weight: 104.15Synonyms: (+/-)-1,2-PENTANEDIOL | FT-0606477 | UNII-50C1307PZG | NSC 513 | PENTYLENE GLYCOL [WHO-DD] | P1178 |...SMILES: CCCC(CO)OInChIKey: WCVRQHFDJLLWFE-UHFFFAOYSA-NInChI: InChI=1S/C5H12O2/c1-2-3-5(7)4-6/h5-7H,2-4H2,1H3
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AZD-8529
Cas Number: 1092453-15-0(DMSO)Formula: C24H24F3N5O3Molecular weight: 487.47SMILES: CC1=CC(=CC2=C1C(=O)N(C2)CC3=CC=C(C=C3)OC(F)(F)F)C4=NC(=NO4)CN5CCNCC5
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AZD-8529 mesylate
Cas Number: 1314217-69-0(DMSO)Formula: C25H28F3N5O6SMolecular weight: 583.6SMILES: CC1=CC(=CC2=C1C(=O)N(C2)CC3=CC=C(C=C3)OC(F)(F)F)C4=NC(=NO4)CN5CCNCC5.CS(=O)(=O)O
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AZD-8529
Cas Number: 1092453-15-0 EC Number: 680-652-6Formula: C24H24F3N5O3Molecular weight: 487.47Synonyms: MS-29057 | UNII-6H81G454I7 | AZD-8529 free base | EX-A7769 | 7-Methyl-5-(3-(piperazin-1-ylmethyl)-1,...SMILES: CC1=CC(=CC2=C1C(=O)N(C2)CC3=CC=C(C=C3)OC(F)(F)F)C4=NC(=NO4)CN5CCNCC5InChIKey: IPCYZQQFECEHLI-UHFFFAOYSA-NInChI: InChI=1S/C24H24F3N5O3/c1-15-10-17(22-29-20(30-35-22)14-31-8-6-28-7-9-31)11-18-13-32(23(33)21(15)18)12-16-2-4-19(5-3-16)34-24(25,26)27/h2-5,10-11,28H,6-9,12-14H2,1H3
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AZD-8529 mesylate
Cas Number: 1314217-69-0Formula: C25H28F3N5O6SMolecular weight: 583.6Synonyms: AZD-8529 mesylate | 1314217-69-0 | HY-107457A | EX-A7769A | methanesulfonic acid;7-methyl-5-[3-(pipe...SMILES: CC1=CC(=CC2=C1C(=O)N(C2)CC3=CC=C(C=C3)OC(F)(F)F)C4=NC(=NO4)CN5CCNCC5.CS(=O)(=O)OInChIKey: HRHCPVNKPOTCGB-UHFFFAOYSA-NInChI: InChI=1S/C24H24F3N5O3.CH4O3S/c1-15-10-17(22-29-20(30-35-22)14-31-8-6-28-7-9-31)11-18-13-32(23(33)21(15)18)12-16-2-4-19(5-3-16)34-24(25,26)27;1-5(2,3)4/h2-5,10-11,28H,6-9,12-14H2,1H3;1H3,(H,2,3,4)
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FK-881, Inhibitor of COX-1;Inhibitor of COX-2
Cas Number: 524699-72-7Synonyms: SCHEMBL1193845 | ASP 6537 | LN4A42V962 | BDBM50084631 | UNII-LN4A42V962 | 3-methoxy-1,5-bis(4-methox...SMILES: COc1ccc(cc1)n1nc(nc1c1ccc(cc1)OC)OCInChIKey: OBAICMYWONZOSZ-UHFFFAOYSA-NInChI: InChI=1S/C17H17N3O3/c1-21-14-8-4-12(5-9-14)16-18-17(23-3)19-20(16)13-6-10-15(22-2)11-7-13/h4-11H,1-3H3
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Vanillin acetate
Formula: C10H10O4Molecular weight: 194.18Synonyms: Vanillin acetate|4-Formyl-2-methoxyphenyl acetate|881-68-5|Acetylvanillin|4-Acetoxy-3-methoxybenzald...SMILES: CC(=O)OC1=C(C=C(C=C1)C=O)OCInChIKey: PZSJOBKRSVRODF-UHFFFAOYSA-NInChI: InChI=1S/C10H10O4/c1-7(12)14-9-4-3-8(6-11)5-10(9)13-2/h3-6H,1-2H3
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TAK-285, Epidermal growth factor receptor erbB1 inhibitor
Cas Number: 871026-44-7Formula: C26H25ClF3N5O3Molecular weight: 547.96Synonyms: CHEBI:102166 | n-{2-[4-({3-chloro-4-[3-(trifluoromethyl)phenoxy]phenyl}amino)-5h-pyrrolo[3,2-d]pyrim...SMILES: CC(C)(CC(=O)NCCN1C=CC2=C1C(=NC=N2)NC3=CC(=C(C=C3)OC4=CC=CC(=C4)C(F)(F)F)Cl)OInChIKey: ZYQXEVJIFYIBHZ-UHFFFAOYSA-NInChI: InChI=1S/C26H25ClF3N5O3/c1-25(2,37)14-22(36)31-9-11-35-10-8-20-23(35)24(33-15-32-20)34-17-6-7-21(19(27)13-17)38-18-5-3-4-16(12-18)26(28,29)30/h3-8,10,12-13,15,37H,9,11,14H2,1-2H3,(H,31,36)(H,32,33,34)
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Dotriacontane
Formula: C32H66Molecular weight: 450.87Synonyms: Bicetyl | CH3-(CH2)30-CH3 | LMFA11000570 | n-Dotriacontane 100 microg/mL in n-Hexane | Dotriacontane...SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCInChIKey: QHMGJGNTMQDRQA-UHFFFAOYSA-NInChI: InChI=1S/C32H66/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
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Avapritinib (BLU-285), Platelet-derived growth factor receptor alpha inhibitor
Cas Number: 1703793-34-3Formula: C26H27FN10Molecular weight: 498.56Synonyms: (1S)-1-(4-FLUOROPHENYL)-1-(2-(4-(6-(1-METHYL-1H-PYRAZOL-4-YL)PYRROLO(2,1-F)(1,2,4)TRIAZIN-4-YL)PIPER...SMILES: CC(C1=CC=C(C=C1)F)(C2=CN=C(N=C2)N3CCN(CC3)C4=NC=NN5C4=CC(=C5)C6=CN(N=C6)C)NInChIKey: DWYRIWUZIJHQKQ-SANMLTNESA-NInChI: InChI=1S/C26H27FN10/c1-26(28,20-3-5-22(27)6-4-20)21-13-29-25(30-14-21)36-9-7-35(8-10-36)24-23-11-18(16-37(23)33-17-31-24)19-12-32-34(2)15-19/h3-6,11-17H,7-10,28H2,1-2H3/t26-/m0/s1
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Avapritinib (BLU-285), Platelet-derived growth factor receptor alpha inhibitor
Cas Number: 1703793-34-3(DMSO)Formula: C26H27FN10Molecular weight: 498.56Synonyms: 5-Pyrimidinemethanamine, α-(4-fluorophenyl)-α-methyl-2-[4-[6-(1-�...
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Coronene
Formula: C24H12Molecular weight: 300.35Synonyms: CORONENE|191-07-1|Hexabenzobenzene|Dibenzo(ghi,pqr)perylene|Dibenzo[ghi,pqr]perylene|CORONENE (D12)|...SMILES: C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC7=C6C3=C(C=C2)C=C7InChIKey: VPUGDVKSAQVFFS-UHFFFAOYSA-NInChI: InChI=1S/C24H12/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19/h1-12H
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