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Search results for: '‘209-953-9'
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Tri-m-cresyl Phosphate
Cas Number: 563-04-2Formula: C21H21O4PMolecular weight: 368.37Synonyms: InChI=1/C21H21O4P/c1-16-7-4-10-19(13-16)23-26(22,24-20-11-5-8-17(2)14-20)25-21-12-6-9-18(3)15-21/h4-...SMILES: CC1=CC(=CC=C1)OP(=O)(OC2=CC=CC(=C2)C)OC3=CC=CC(=C3)CInChIKey: RMLPZKRPSQVRAB-UHFFFAOYSA-NInChI: InChI=1S/C21H21O4P/c1-16-7-4-10-19(13-16)23-26(22,24-20-11-5-8-17(2)14-20)25-21-12-6-9-18(3)15-21/h4-15H,1-3H3
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3-Methyl-2-pentanol (mixture of diastereoisomers)
Cas Number: 565-60-6Formula: C6H14OMolecular weight: 102.18Synonyms: Q3278289 | sec-Butyl methyl carbinol | FT-0694658 | 3-METHYL-2-PENTANOL | MFCD00004528 | ZXNBBWHRUSX...SMILES: CCC(C)C(C)OInChIKey: ZXNBBWHRUSXUFZ-UHFFFAOYSA-NInChI: InChI=1S/C6H14O/c1-4-5(2)6(3)7/h5-7H,4H2,1-3H3
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Dabigatran (BIBR 953), Thrombin inhibitor
Cas Number: 211914-51-1Formula: C25H25N7O3Molecular weight: 471.51Synonyms: 3-[[2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]pro...SMILES: CN1C2=C(C=C(C=C2)C(=O)N(CCC(=O)O)C3=CC=CC=N3)N=C1CNC4=CC=C(C=C4)C(=N)NInChIKey: YBSJFWOBGCMAKL-UHFFFAOYSA-NInChI: InChI=1S/C25H25N7O3/c1-31-20-10-7-17(25(35)32(13-11-23(33)34)21-4-2-3-12-28-21)14-19(20)30-22(31)15-29-18-8-5-16(6-9-18)24(26)27/h2-10,12,14,29H,11,13,15H2,1H3,(H3,26,27)(H,33,34)
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Diphenyl-2-pyridylmethane
Cas Number: 3678-70-4Formula: C18H15NMolecular weight: 245.3Synonyms: Diphenyl-2-pyridylmethane | 2-Benzhydrylpyridine | Pyridine, 2-(diphenylmethyl)- | 2-(diphenylmethyl...SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=CC=N3InChIKey: MMXYNKLYVRNTCK-UHFFFAOYSA-NInChI: InChI=1S/C18H15N/c1-3-9-15(10-4-1)18(16-11-5-2-6-12-16)17-13-7-8-14-19-17/h1-14,18H
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16-Hentriacontanone
Cas Number: 502-73-8Formula: C31H62OMolecular weight: 450.84Synonyms: DTXSID00198239 | UNII-GR7I8IC3NO | Palmitone | D90862 | Q27106854 | Hentricontan-16-one | NSC 953 | ...SMILES: CCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCCInChIKey: UNRFDARCMOHDBJ-UHFFFAOYSA-NInChI: InChI=1S/C31H62O/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/h3-30H2,1-2H3
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(E)-Ethyl 4-Nitrocinnamate
Cas Number: 24393-61-1Formula: C11H11NO4Molecular weight: 221.21Synonyms: Ethyl 4-nitrocinnamate|953-26-4|Ethyl p-nitrocinnamate|24393-61-1|2-Propenoic acid, 3-(4-nitrophenyl...SMILES: CCOC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-]InChIKey: PFBQVGXIMLXCQB-VMPITWQZSA-NInChI: InChI=1S/C11H11NO4/c1-2-16-11(13)8-5-9-3-6-10(7-4-9)12(14)15/h3-8H,2H2,1H3/b8-5+
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Phosphocholine Chloride Sodium Salt Hydrate
Cas Number: 16904-96-4Formula: C5H13ClNNa2O4P·xH2OMolecular weight: 263.57(Anhydrous)Synonyms: Phosphocholine chloride sodium salt hydrate | Phosphorylcholine Chloride Sodium Salt | J-010503 | EI...SMILES: C[N+](C)(C)CCOP(=O)([O-])[O-].[Na+].[Na+].[Cl-]InChIKey: HMCRHROSIPYRGL-UHFFFAOYSA-LInChI: InChI=1S/C5H14NO4P.ClH.2Na/c1-6(2,3)4-5-10-11(7,8)9;;;/h4-5H2,1-3H3,(H-,7,8,9);1H;;/q;;2*+1/p-2
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clobetasone
Synonyms: Clobetasonum [INN-Latin] | SCHEMBL3581 | Clobetasona | EINECS 258-953-5 | Clobetasone [INN:BAN] | Q5...SMILES: ClCC(=O)[C@@]1(O)[C@@H](C)C[C@@H]2[C@]1(C)CC(=O)[C@]1([C@H]2CCC2=CC(=O)C=C[C@]12C)FInChIKey: XXIFVOHLGBURIG-OZCCCYNHSA-NInChI: InChI=1S/C22H26ClFO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,24)17(26)10-20(16,3)22(12,28)18(27)11-23/h6-7,9,12,15-16,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,19-,20-,21-,22-/m0/s1
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2-(2-Hydroxypropan-2-yl)-5-methylcyclohexanol(Mixture of isomers)
Cas Number: 42822-86-6Formula: C10H20O2Molecular weight: 172.26Synonyms: AMY584 | (+/-)-P-MENTHANE-3,8-DIOL | FEMA NO. 4053 | AS-57135 | FT-0623947 | 2-(2-Hydroxypropan-2-yl...SMILES: CC1CCC(C(C1)O)C(C)(C)OInChIKey: LMXFTMYMHGYJEI-UHFFFAOYSA-NInChI: InChI=1S/C10H20O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-9,11-12H,4-6H2,1-3H3
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PTC-209 HBr
Cas Number: 1217022-63-3Formula: C17H14Br3N5OSMolecular weight: 576.1Synonyms: PTC-209 hydrobromide | N-(2,6-dibromo-4-methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)thiaz...SMILES: CC1=C(N2C=CC=NC2=N1)C3=CSC(=N3)NC4=C(C=C(C=C4Br)OC)Br.BrInChIKey: UOPFJYYKFDZXSY-UHFFFAOYSA-NInChI: InChI=1S/C17H13Br2N5OS.BrH/c1-9-15(24-5-3-4-20-16(24)21-9)13-8-26-17(22-13)23-14-11(18)6-10(25-2)7-12(14)19;/h3-8H,1-2H3,(H,22,23);1H
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Propylene glycol caprylate
Cas Number: 31565-12-5 EC Number: 953-046-7SMILES: CCCCCCCC(=O)OCC(C)OInChIKey: GHHURQMJLARIDK-UHFFFAOYSA-NInChI: InChI=1S/C11H22O3/c1-3-4-5-6-7-8-11(13)14-9-10(2)12/h10,12H,3-9H2,1-2H3
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PTC 209
Cas Number: 315704-66-6Formula: C17H13Br2N5OSMolecular weight: 495.19Synonyms: PTC-209|315704-66-6|N-(2,6-dibromo-4-methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)thiazol-...SMILES: CC1=C(N2C=CC=NC2=N1)C3=CSC(=N3)NC4=C(C=C(C=C4Br)OC)BrInChIKey: XVOOCQSWCCRVDY-UHFFFAOYSA-NInChI: InChI=1S/C17H13Br2N5OS/c1-9-15(24-5-3-4-20-16(24)21-9)13-8-26-17(22-13)23-14-11(18)6-10(25-2)7-12(14)19/h3-8H,1-2H3,(H,22,23)
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WYC-209
Cas Number: 2131803-90-0Formula: C20H20N2O3SMolecular weight: 368.5Synonyms: Ethyl 2-((4,4-dimethyl-1-oxidothiochroman-6-yl)ethynyl)pyrimidine-5-carboxylateSMILES: CCOC(=O)C1=CN=C(N=C1)C#CC2=CC3=C(C=C2)S(=O)CCC3(C)CInChIKey: LLMDAYVUHYVJSS-UHFFFAOYSA-NInChI: InChI=1S/C20H20N2O3S/c1-4-25-19(23)15-12-21-18(22-13-15)8-6-14-5-7-17-16(11-14)20(2,3)9-10-26(17)24/h5,7,11-13H,4,9-10H2,1-3H3
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(±)-ML 209
Cas Number: 1334526-14-5Formula: C25H31NO6Molecular weight: 441.52Synonyms: 3-(1,3-Benzodioxol-5-yl)-1-(cis-3,5-dimethyl-1-piperidinyl)-3-(2-hydroxy-4,6-dimethoxyphenyl)-1-prop...SMILES: CC1CC(CN(C1)C(=O)CC(C2=CC3=C(C=C2)OCO3)C4=C(C=C(C=C4OC)OC)O)CInChIKey: YEKVAIMYYCZDLI-MCPYQZEQSA-NInChI: InChI=1S/C25H31NO6/c1-15-7-16(2)13-26(12-15)24(28)11-19(17-5-6-21-22(8-17)32-14-31-21)25-20(27)9-18(29-3)10-23(25)30-4/h5-6,8-10,15-16,19,27H,7,11-14H2,1-4H3/t15-,16+,19?
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SRX246
Cas Number: 512784-93-9(DMSO)Formula: C42H49N5O5Molecular weight: 703.87SMILES: CC(C1=CC=CC=C1)NC(=O)C(CC(=O)N2CCC(CC2)N3CCCCC3)N4C(C(C4=O)N5C(COC5=O)C6=CC=CC=C6)C=CC7=CC=CC=C7
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PCB No 209 solution
Formula: C12Cl10Molecular weight: 498.66Synonyms: DECACHLOROBIPHENYL|2051-24-3|PCB 209|Perchlorobiphenyl|Decachloro-1,1'-biphenyl|Biphenyl, decachloro...SMILES: C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)ClInChIKey: ONXPZLFXDMAPRO-UHFFFAOYSA-NInChI: InChI=1S/C12Cl10/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16
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Dabigatran-d3
Cas Number: 1246817-44-6Formula: C25H22D3N7O3Molecular weight: 474.53Synonyms: HY-10163S1 | Dabigatran-d3 | N-{2-[(4-Carbamimidoylanilino)methyl]-1-(~2~H_3_)methyl-1H-benzimidazol...SMILES: CN1C2=C(C=C(C=C2)C(=O)N(CCC(=O)O)C3=CC=CC=N3)N=C1CNC4=CC=C(C=C4)C(=N)NInChIKey: YBSJFWOBGCMAKL-FIBGUPNXSA-NInChI: InChI=1S/C25H25N7O3/c1-31-20-10-7-17(25(35)32(13-11-23(33)34)21-4-2-3-12-28-21)14-19(20)30-22(31)15-29-18-8-5-16(6-9-18)24(26)27/h2-10,12,14,29H,11,13,15H2,1H3,(H3,26,27)(H,33,34)/i1D3
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Mequitazine, Histamine H1 receptor antagonist
Cas Number: 29216-28-2Formula: C20H22N2SMolecular weight: 322.47Synonyms: mequitazine|29216-28-2|Metaplexan|Primalan|Virginan|Mircol|Instotal|Vigigan|Mequitazina [Spanish]|Ki...SMILES: C1CN2CCC1C(C2)CN3C4=CC=CC=C4SC5=CC=CC=C53InChIKey: HOKDBMAJZXIPGC-UHFFFAOYSA-NInChI: InChI=1S/C20H22N2S/c1-3-7-19-17(5-1)22(18-6-2-4-8-20(18)23-19)14-16-13-21-11-9-15(16)10-12-21/h1-8,15-16H,9-14H2
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17-AAG
Cas Number: 75747-14-7Formula: C31H43N3O8Molecular weight: 585.69Synonyms: Allylamino-17-demethoxygeldanamycin, 17- | CNF1010 | CNF-1010 | 17-(Allylamino) Geldanamycin | BRN 0...SMILES: CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)NCC=C)C)OC)OC(=O)N)C)C)O)OCInChIKey: AYUNIORJHRXIBJ-TXHRRWQRSA-NInChI: See more
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1-Cbz-3-Cyanopiperidine
Cas Number: 885069-22-7 EC Number: 675-953-4Formula: C14H16N2O2Molecular weight: 244.29Synonyms: Benzyl 3-cyanopiperidine-1-carboxylateSMILES: C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)C#NInChIKey: GTUBNUQWSDFBEE-UHFFFAOYSA-NInChI: InChI=1S/C14H16N2O2/c15-9-13-7-4-8-16(10-13)14(17)18-11-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-8,10-11H2
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Potassium benzoate
Formula: C7H5KO2Molecular weight: 160.21Synonyms: potassium;benzoate | 763YQN2K7K | EINECS 209-481-3 | INS NO.212 | SCHEMBL16121 | FT-0632435 | Potass...SMILES: C1=CC=C(C=C1)C(=O)[O-].[K+]InChIKey: XAEFZNCEHLXOMS-UHFFFAOYSA-MInChI: InChI=1S/C7H6O2.K/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);/q;+1/p-1
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