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Search results for: '127308-82-1'
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Methyl 1-Cbz-3-methylpiperidine-3-carboxylate
Cas Number: 174543-82-9Formula: C16H21NO4Molecular weight: 291.34Synonyms: 174543-82-9|Methyl 1-Cbz-3-methylpiperidine-3-carboxylate|1-Benzyl 3-methyl 3-methylpiperidine-1,3-d...SMILES: CC1(CCCN(C1)C(=O)OCC2=CC=CC=C2)C(=O)OCInChIKey: OBQNDANRDMXAIE-UHFFFAOYSA-NInChI: InChI=1S/C16H21NO4/c1-16(14(18)20-2)9-6-10-17(12-16)15(19)21-11-13-7-4-3-5-8-13/h3-5,7-8H,6,9-12H2,1-2H3
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3-(4-(BOC-Piperazine-1-carbonyl)phenylboronic acid
Cas Number: 1218790-82-9Formula: C16H23BN2O5Molecular weight: 334.2Synonyms: 1218790-82-9|(3-(4-(tert-Butoxycarbonyl)piperazine-1-carbonyl)phenyl)boronic acid|3-(4-(BOC-Piperazi...SMILES: B(C1=CC(=CC=C1)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C)(O)OInChIKey: ULYBKVRJSMFUJC-UHFFFAOYSA-NInChI: InChI=1S/C16H23BN2O5/c1-16(2,3)24-15(21)19-9-7-18(8-10-19)14(20)12-5-4-6-13(11-12)17(22)23/h4-6,11,22-23H,7-10H2,1-3H3
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X-82 (Vorolanib)
Cas Number: 1013920-15-4Formula: C23H26FN5O3Molecular weight: 439.4Synonyms: Vorolanib|1013920-15-4|Vorolanib [INN]|YP8G3I74EL|CM082|N-[(3S)-1-(dimethylcarbamoyl)pyrrolidin-3-yl...SMILES: CC1=C(NC(=C1C(=O)NC2CCN(C2)C(=O)N(C)C)C)C=C3C4=C(C=CC(=C4)F)NC3=OInChIKey: KMIOJWCYOHBUJS-HAKPAVFJSA-NInChI: InChI=1S/C23H26FN5O3/c1-12-19(10-17-16-9-14(24)5-6-18(16)27-21(17)30)25-13(2)20(12)22(31)26-15-7-8-29(11-15)23(32)28(3)4/h5-6,9-10,15,25H,7-8,11H2,1-4H3,(H,26,31)(H,27,30)/b17-10-/t15-/m0/s1
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2-Bromo-5-iodo-4-nitrobenzotrifluoride
Cas Number: 1187385-82-5Formula: C7H2BrF3INO2Molecular weight: 395.9Synonyms: AMY7069 | BS-25664 | C7H2BrF3INO2 | 1187385-82-5 | E84215 | MFCD12913962 | AKOS015888956 | CS-043795...SMILES: C1=C(C(=CC(=C1I)[N+](=O)[O-])Br)C(F)(F)FInChIKey: VKMQPFOZIBWBPJ-UHFFFAOYSA-NInChI: InChI=1S/C7H2BrF3INO2/c8-4-2-6(13(14)15)5(12)1-3(4)7(9,10)11/h1-2H
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4-Hydroxy-2-oxopyrrolidine-N-acetamide
Cas Number: 62613-82-5Formula: C6H10N2O3Molecular weight: 158.16Synonyms: oxiracetam|62613-82-5|2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide|4-Hydroxy-2-oxopyrrolidine-N-aceta...SMILES: C1C(CN(C1=O)CC(=O)N)OInChIKey: IHLAQQPQKRMGSS-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2O3/c7-5(10)3-8-2-4(9)1-6(8)11/h4,9H,1-3H2,(H2,7,10)
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methyl (1S,2S)-2-(tert-butoxycarbonylamino)cyclopentanecarboxylate
Cas Number: 192385-82-3Formula: C12H21NO4Molecular weight: 243.3Synonyms: 192385-82-3 | methyl (1S,2S)-2-{[(tert-butoxy)carbonyl]amino}cyclopentane-1-carboxylate | methyl (1S...SMILES: CC(C)(C)OC(=O)NC1CCCC1C(=O)OCInChIKey: LVSNFSRSQZFNPY-IUCAKERBSA-NInChI: InChI=1S/C12H21NO4/c1-12(2,3)17-11(15)13-9-7-5-6-8(9)10(14)16-4/h8-9H,5-7H2,1-4H3,(H,13,15)/t8-,9-/m0/s1
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1-Amino-2-bromo-4-hydroxyanthraquinone
Cas Number: 116-82-5Formula: C14H8BrNO3Molecular weight: 318.129Synonyms: 116-82-5|1-Amino-2-bromo-4-hydroxyanthraquinone|Disperse Violet 17|1-amino-2-bromo-4-hydroxyanthrace...SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)Br)NInChIKey: MSSQDESMUMSQEN-UHFFFAOYSA-NInChI: InChI=1S/C14H8BrNO3/c15-8-5-9(17)10-11(12(8)16)14(19)7-4-2-1-3-6(7)13(10)18/h1-5,17H,16H2
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1-(Pyridin-4-ylmethyl)piperidin-4-one
Cas Number: 126832-82-4Formula: C11H14N2OMolecular weight: 190.24Synonyms: 126832-82-4|1-(pyridin-4-ylmethyl)piperidin-4-one|1-PYRIDIN-4-YL-METHYLPIPERIDIN-4-ONE|1-(4-Pyridiny...SMILES: C1CN(CCC1=O)CC2=CC=NC=C2InChIKey: HGXOGFPPULJEEV-UHFFFAOYSA-NInChI: InChI=1S/C11H14N2O/c14-11-3-7-13(8-4-11)9-10-1-5-12-6-2-10/h1-2,5-6H,3-4,7-9H2
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5-Bromo-2-methoxyquinoline-8-carbaldehyde
Cas Number: 885687-82-1Formula: C11H8BrNO2Molecular weight: 266.09Synonyms: 5-Bromo-2-methoxyquinoline-8-carbaldehyde|885687-82-1|5-Bromo-2-methoxy-8-quinolinecarboxaldehyde|DT...SMILES: COC1=NC2=C(C=CC(=C2C=C1)Br)C=OInChIKey: IGLZFFUNRZEBSG-UHFFFAOYSA-NInChI: InChI=1S/C11H8BrNO2/c1-15-10-5-3-8-9(12)4-2-7(6-14)11(8)13-10/h2-6H,1H3
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Vildagliptin-d3
Cas Number: 1217546-82-1Formula: C17H22D3N3O2Molecular weight: 306.42Synonyms: (2S)-2,5,5-trideuterio-1-[2-[[(5S,7R)-3-hydroxy-1-adamantyl]amino]acetyl]pyrrolidine-2-carbonitrile ...SMILES: C1CC(N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C#NInChIKey: SYOKIDBDQMKNDQ-COZVPQRFSA-NInChI: InChI=1S/C17H25N3O2/c18-9-14-2-1-3-20(14)15(21)10-19-16-5-12-4-13(6-16)8-17(22,7-12)11-16/h12-14,19,22H,1-8,10-11H2/t12-,13+,14-,16?,17?/m0/s1/i3D2,14D
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MGITC
Cas Number: 147492-82-8Formula: C24H24ClN3O4SMolecular weight: 485.98Synonyms: 147492-82-8|malachite green isothiocyanate|MGITC [Malachite green isothiocyanate]|MGITC [Malachite ...SMILES: CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N=C=S.[Cl-]InChIKey: NMHKCKDPHMNGHC-UHFFFAOYSA-MInChI: InChI=1S/C24H24N3S.ClH/c1-26(2)22-13-7-19(8-14-22)24(18-5-11-21(12-6-18)25-17-28)20-9-15-23(16-10-20)27(3)4;/h5-16H,1-4H3;1H/q+1;/p-1
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3-Methyl-2-buten-1-ol
Cas Number: 556-82-1(DMSO)Formula: C5H10OMolecular weight: 86.13Synonyms: 3-Methyl-2-buten-1-ol, >=98%, FG | NCGC00257241-01 | s3123 | ISOPENT-2-EN-1-OL | 3-Methyl-2-buten-1-...
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C-82
Cas Number: 1422253-37-9Formula: C33H34N6O4Molecular weight: 578.7Synonyms: C-82|1422253-37-9|UNII-D33SM48G6V|D33SM48G6V|CID 73602848|(6S,9S,9AS)-N-benzyl-6-(4-hydroxybenzyl)-2...SMILES: CC1C2N(C(C(=O)N1CC3=CC=CC4=C3N=CC=C4)CC5=CC=C(C=C5)O)C(=O)CN(N2C(=O)NCC6=CC=CC=C6)CInChIKey: KLGHKOORFHZFGO-AZXNYEMZSA-NInChI: See more
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5-Ethyl-2,3-dihydro-1H-inden-1-one
Cas Number: 4600-82-2Formula: C11H12OMolecular weight: 160.2Synonyms: 5-ETHYL-2,3-DIHYDRO-1H-INDEN-1-ONE|4600-82-2|5-ethyl-2,3-dihydroinden-1-one|5-ethyl-1-indanone|SCHEM...SMILES: CCC1=CC2=C(C=C1)C(=O)CC2InChIKey: XORGYZYRXXTLOB-UHFFFAOYSA-NInChI: InChI=1S/C11H12O/c1-2-8-3-5-10-9(7-8)4-6-11(10)12/h3,5,7H,2,4,6H2,1H3
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5-(3-Nitrophenyl)-1H-pyrazole-3-carboxylic acid
Cas Number: 1557038-82-0Formula: C10H7N3O4Molecular weight: 233.18Synonyms: MLS000673847 | SR-01000147384 | F1967-0140 | A860966 | HMS2718C22 | 1557038-82-0 | MFCD05864799 | ST...SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C2=NNC(=C2)C(=O)OInChIKey: KOYVJIGBLQRTRF-UHFFFAOYSA-NInChI: InChI=1S/C10H7N3O4/c14-10(15)9-5-8(11-12-9)6-2-1-3-7(4-6)13(16)17/h1-5H,(H,11,12)(H,14,15)
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IPA-3, Inhibitor of p21 (RAC1) activated kinase 1
Cas Number: 42521-82-4Formula: C20H14O2S2Molecular weight: 350.45Synonyms: IPA-3|42521-82-4|IPA 3|Bis(2-hydroxy-1-naphthyl) disulfide|1,1'-Dithiodi-2-naphthol|1,1'-disulfanedi...SMILES: C1=CC=C2C(=C1)C=CC(=C2SSC3=C(C=CC4=CC=CC=C43)O)OInChIKey: RFAXLXKIAKIUDT-UHFFFAOYSA-NInChI: InChI=1S/C20H14O2S2/c21-17-11-9-13-5-1-3-7-15(13)19(17)23-24-20-16-8-4-2-6-14(16)10-12-18(20)22/h1-12,21-22H
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5-Amino-4-cyano-1-(4-chlorophenyl)-3-methylpyrazole
Cas Number: 58791-82-5Formula: C11H9ClN4Molecular weight: 232.7Synonyms: 58791-82-5|5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile|5-Amino-4-cyano-1-(4-chlor...SMILES: CC1=NN(C(=C1C#N)N)C2=CC=C(C=C2)ClInChIKey: CSGUNONDPWAJAJ-UHFFFAOYSA-NInChI: InChI=1S/C11H9ClN4/c1-7-10(6-13)11(14)16(15-7)9-4-2-8(12)3-5-9/h2-5H,14H2,1H3
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1-Bromo-4-(trans-4-ethylcyclohexyl)benzene
Cas Number: 91538-82-8Formula: C14H19BrMolecular weight: 267.2Synonyms: 1-Bromo-4-(trans-4-ethylcyclohexyl)benzene|91538-82-8|1-bromo-4-(4-ethylcyclohexyl)benzene|1-bromo-4...SMILES: CCC1CCC(CC1)C2=CC=C(C=C2)BrInChIKey: UZNPLXSOLSAKGB-UHFFFAOYSA-NInChI: InChI=1S/C14H19Br/c1-2-11-3-5-12(6-4-11)13-7-9-14(15)10-8-13/h7-12H,2-6H2,1H3
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PF-543, Inhibitor of sphingosine kinase 1;Inhibitor of sphingosine kinase 2
Cas Number: 1415562-82-1Formula: C27H31NO4SMolecular weight: 465.6Synonyms: PF-543|1415562-82-1|PF 543|Sphingosine Kinase 1 Inhibitor II|PF543|CHEMBL3134157|[(2R)-1-[[4-[[3-(be...SMILES: CC1=CC(=CC(=C1)OCC2=CC=C(C=C2)CN3CCCC3CO)CS(=O)(=O)C4=CC=CC=C4InChIKey: NPUXORBZRBIOMQ-RUZDIDTESA-NInChI: InChI=1S/C27H31NO4S/c1-21-14-24(20-33(30,31)27-7-3-2-4-8-27)16-26(15-21)32-19-23-11-9-22(10-12-23)17-28-13-5-6-25(28)18-29/h2-4,7-12,14-16,25,29H,5-6,13,17-20H2,1H3/t25-/m1/s1
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(2S)-3-methyl-2-(pyrrolidin-1-yl)butanoic acid
Cas Number: 777839-82-4Formula: C9H17NO2Molecular weight: 171.24Synonyms: (S)-3-Methyl-2-(1-pyrrolidinyl)butyric Acid | 777839-82-4 | (2S)-3-METHYL-2-(PYRROLIDIN-1-YL)BUTANOI...SMILES: CC(C)C(C(=O)O)N1CCCC1InChIKey: XXAWWQYJXDAKIM-QMMMGPOBSA-NInChI: InChI=1S/C9H17NO2/c1-7(2)8(9(11)12)10-5-3-4-6-10/h7-8H,3-6H2,1-2H3,(H,11,12)/t8-/m0/s1
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3-(2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)propanoic acid
Cas Number: 2950-82-5Formula: C7H8N2O4Molecular weight: 184.15Synonyms: 2950-82-5|1(2H)-Pyrimidinepropanoic acid, 3,4-dihydro-2,4-dioxo-|3-(2,4-Dioxo-3,4-dihydro-2H-pyrimid...SMILES: C1=CN(C(=O)NC1=O)CCC(=O)OInChIKey: LREWQDQQBBUISJ-UHFFFAOYSA-NInChI: InChI=1S/C7H8N2O4/c10-5-1-3-9(7(13)8-5)4-2-6(11)12/h1,3H,2,4H2,(H,11,12)(H,8,10,13)
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Sulfur standard solution
Formula: Na2SO4Molecular weight: 142.04Synonyms: SODIUM SULFATE|7757-82-6|Disodium sulfate|Sodium sulfate, anhydrous|Sodium sulfate anhydrous|Salt ca...SMILES: [O-]S(=O)(=O)[O-].[Na+].[Na+]InChIKey: PMZURENOXWZQFD-UHFFFAOYSA-LInChI: InChI=1S/2Na.H2O4S/c;;1-5(2,3)4/h;;(H2,1,2,3,4)/q2*+1;/p-2
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4-Amino-n-butylbenzenesulfonamide
Cas Number: 1829-82-9Formula: C10H16N2O2SMolecular weight: 228.3Synonyms: 4-amino-N-butylbenzenesulfonamide|1829-82-9|Benzenesulfonamide, 4-amino-n-butyl-|NSC151244|4-AMINO-N...SMILES: CCCCNS(=O)(=O)C1=CC=C(C=C1)NInChIKey: XXRNQEBDIQPZRC-UHFFFAOYSA-NInChI: InChI=1S/C10H16N2O2S/c1-2-3-8-12-15(13,14)10-6-4-9(11)5-7-10/h4-7,12H,2-3,8,11H2,1H3
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(1R,2R)-2-fluorocyclopentan-1-amine hydrochloride
Cas Number: 2227197-40-0Synonyms: trans-2-fluorocyclopentan-1-amine hydrochloride | 2125943-82-8 | 2227197-40-0 | trans-2-fluorocyclop...SMILES: C1CC(C(C1)F)N.ClInChIKey: ZJXOEOALNHXCOE-TYSVMGFPSA-NInChI: InChI=1S/C5H10FN.ClH/c6-4-2-1-3-5(4)7;/h4-5H,1-3,7H2;1H/t4-,5-;/m1./s1
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