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Search results for: '54-05-7'
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Chloroquine, Agonist of MRGPRX1;Agonist of TAS2R3
Formula: C18H26ClN3Molecular weight: 319.87Synonyms: chloroquine|54-05-7|Aralen|Chlorochin|Chloraquine|Artrichin|Chloroquina|Chloroquinium|Capquin|Reumac...SMILES: CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)ClInChIKey: WHTVZRBIWZFKQO-UHFFFAOYSA-NInChI: InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)
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2,2'6,6'-Tetrachlorobiphenyl
Cas Number: 15968-05-5Formula: C12H6Cl4Molecular weight: 291.99Synonyms: 2,2',6,6'-TETRACHLOROBIPHENYL|15968-05-5|2,2',6,6'-Tetrachloro-1,1'-biphenyl|PCB 54|1,1'-Biphenyl, 2...SMILES: C1=CC(=C(C(=C1)Cl)C2=C(C=CC=C2Cl)Cl)ClInChIKey: PXAGFNRKXSYIHU-UHFFFAOYSA-NInChI: InChI=1S/C12H6Cl4/c13-7-3-1-4-8(14)11(7)12-9(15)5-2-6-10(12)16/h1-6H
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1-Hexadecanol
Cas Number: 36653-82-4 EC Number: 253-149-0Formula: C16H34OMolecular weight: 242.44Synonyms: Cachalot C-52 | 4-01-00-01876 (Beilstein Handbook Reference) | Caswell No. 165D | Isocetyl alcohol |...SMILES: CCCCCCCCCCCCCCCCOInChIKey: BXWNKGSJHAJOGX-UHFFFAOYSA-NInChI: InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3
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spiro[3.5]nonan-2-ylmethanol
Cas Number: 1363360-05-7Formula: C10H18OMolecular weight: 154.25Synonyms: spiro[3.5]nonan-2-ylmethanol | 1363360-05-7 | SCHEMBL15090861 | MFCD28515479 | AT29110SMILES: C1CCC2(CC1)CC(C2)COInChIKey: MNYQCJJIFRHAKD-UHFFFAOYSA-NInChI: InChI=1S/C10H18O/c11-8-9-6-10(7-9)4-2-1-3-5-10/h9,11H,1-8H2
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3-(fluoromethyl)azetidine-3-carboxylic acid;hydrochloride
Cas Number: 1228583-54-7Synonyms: 3-(Fluoromethyl)azetidine-3-carboxylic acid hydrochloride | 1228583-54-7 | F89189SMILES: C1C(CN1)(CF)C(=O)O.ClInChIKey: YTCYMZRAIZAFFF-UHFFFAOYSA-NInChI: InChI=1S/C5H8FNO2.ClH/c6-1-5(4(8)9)2-7-3-5;/h7H,1-3H2,(H,8,9);1H
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6-bromo-7-fluoro-1,3-benzothiazole
Cas Number: 2306278-05-5Formula: C7H3NFSBrMolecular weight: 232.07Synonyms: 6-bromo-7-fluoro-1,3-benzothiazole | 2306278-05-5 | 6-Bromo-7-fluorobenzo[d]thiazole | MFCD31925498 ...SMILES: C1=CC(=C(C2=C1N=CS2)F)BrInChIKey: KFZIUJDNZGMEMM-UHFFFAOYSA-NInChI: InChI=1S/C7H3BrFNS/c8-4-1-2-5-7(6(4)9)11-3-10-5/h1-3H
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3-bromo-7-chloroquinoline
Cas Number: 84973-05-7Formula: C9H5BrClNMolecular weight: 242.5Synonyms: 3-BROMO-7-CHLOROQUINOLINE|84973-05-7|MFCD18253966|SCHEMBL10688343|DTXSID00561646|AULIHGFJRSSSKE-UHFF...SMILES: C1=CC(=CC2=NC=C(C=C21)Br)ClInChIKey: AULIHGFJRSSSKE-UHFFFAOYSA-NInChI: InChI=1S/C9H5BrClN/c10-7-3-6-1-2-8(11)4-9(6)12-5-7/h1-5H
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3-(Methoxymethylene)oxetane
Cas Number: 1313739-05-7Formula: C5H8O2Molecular weight: 100.12Synonyms: 3-(METHOXYMETHYLENE)OXETANE|1313739-05-7|3-(methoxymethylidene)oxetane|MFCD18839252|DTXSID20718493|A...SMILES: COC=C1COC1InChIKey: KIOZXWLYKFVVIU-UHFFFAOYSA-NInChI: InChI=1S/C5H8O2/c1-6-2-5-3-7-4-5/h2H,3-4H2,1H3
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5-chloro-1-methyl-1H-pyrrolo[2,3-c]pyridine-3-carbonitrile
Cas Number: 2092824-54-7Formula: C9H6ClN3Molecular weight: 191.62Synonyms: 5-chloro-1-methyl-1H-pyrrolo[2,3-c]pyridine-3-carbonitrile | 2092824-54-7 | PB48073 | E88222SMILES: CN1C=C(C2=CC(=NC=C21)Cl)C#NInChIKey: BFRSPBHUYAAGSK-UHFFFAOYSA-NInChI: InChI=1S/C9H6ClN3/c1-13-5-6(3-11)7-2-9(10)12-4-8(7)13/h2,4-5H,1H3
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6-chloro-7-fluoro-1H-pyrazolo[4,3-c]pyridine
Cas Number: 1935965-54-0Formula: C6H3N3FClMolecular weight: 171.56Synonyms: 6-chloro-7-fluoro-1H-pyrazolo[4,3-c]pyridine | 1935965-54-0 | SCHEMBL23994487 | MFCD28502713 | D9705...SMILES: C1=C2C=NNC2=C(C(=N1)Cl)FInChIKey: BMFCFVHZHXDKRV-UHFFFAOYSA-NInChI: InChI=1S/C6H3ClFN3/c7-6-4(8)5-3(1-9-6)2-10-11-5/h1-2H,(H,10,11)
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7-bromo-1H-pyrido[2,3-b]pyrazin-2-one
Cas Number: 959616-05-8Formula: C7H4N3OBrMolecular weight: 226.03Synonyms: 7-bromopyrido(2,3-b)pyrazin-2(1H)-one | 7-Bromopyrido[2,3-b]pyrazin-2(1H)-one | 959616-05-8 | SCHEMB...SMILES: C1=C(C=NC2=C1NC(=O)C=N2)BrInChIKey: XVIJHQDLXYIDML-UHFFFAOYSA-NInChI: InChI=1S/C7H4BrN3O/c8-4-1-5-7(9-2-4)10-3-6(12)11-5/h1-3H,(H,11,12)
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Methyl 7-hydroxy-2-naphthoate
Cas Number: 95901-05-6Formula: C12H10O3Molecular weight: 202.21Synonyms: METHYL 7-HYDROXY-2-NAPHTHOATE|95901-05-6|Methyl 7-hydroxynaphthalene-2-carboxylate|MFCD11226994|2-Na...SMILES: COC(=O)C1=CC2=C(C=C1)C=CC(=C2)OInChIKey: NRAOMQRRELNKIQ-UHFFFAOYSA-NInChI: InChI=1S/C12H10O3/c1-15-12(14)9-3-2-8-4-5-11(13)7-10(8)6-9/h2-7,13H,1H3
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7-Bromo-1,3-benzothiazol-2-amine
Cas Number: 20358-05-8Formula: C7H5BrN2SMolecular weight: 229.1Synonyms: 20358-05-8|7-Bromo-1,3-benzothiazol-2-amine|7-Bromobenzo[d]thiazol-2-amine|2-Amino-7-bromobenzothiaz...SMILES: C1=CC2=C(C(=C1)Br)SC(=N2)NInChIKey: YHKASBDRJLTLHH-UHFFFAOYSA-NInChI: InChI=1S/C7H5BrN2S/c8-4-2-1-3-5-6(4)11-7(9)10-5/h1-3H,(H2,9,10)
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3-methyl-7-(trifluoromethyl)-2H-isoquinolin-1-one
Cas Number: 1893330-54-5Formula: C11H8NOF3Molecular weight: 227.18Synonyms: 3-methyl-7-(trifluoromethyl)-2H-isoquinolin-1-one | 1893330-54-5 | MFCD31697824 | PB41538 | AS-84582...SMILES: CC1=CC2=C(C=C(C=C2)C(F)(F)F)C(=O)N1InChIKey: NZVFCGPIZPRTBK-UHFFFAOYSA-NInChI: InChI=1S/C11H8F3NO/c1-6-4-7-2-3-8(11(12,13)14)5-9(7)10(16)15-6/h2-5H,1H3,(H,15,16)
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2-azabicyclo[3.1.1]heptane hydrochloride
Cas Number: 2171280-54-7Synonyms: 2-Azabicyclo[3.1.1]heptane hydrochloride | 2171280-54-7 | (1r,5s)-2-azabicyclo[3.1.1]heptane hydroch...SMILES: C1CNC2CC1C2.ClInChIKey: LJXVTNBUFMWFLM-UHFFFAOYSA-NInChI: InChI=1S/C6H11N.ClH/c1-2-7-6-3-5(1)4-6;/h5-7H,1-4H2;1H
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3-Methyloxetan-2-one
Cas Number: 1823-54-7Formula: C4H6O2Molecular weight: 86.09Synonyms: 3-methyloxetan-2-one|1823-54-7|2-oxetanone, 3-methyl-|alpha-methyl-beta-propiolactone|DTXSID50436759...SMILES: CC1COC1=OInChIKey: NYBXFCLDEATPCM-UHFFFAOYSA-NInChI: InChI=1S/C4H6O2/c1-3-2-6-4(3)5/h3H,2H2,1H3
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(2-methyl-2H-indazol-7-yl)methanol
Cas Number: 1159511-54-2Formula: C9H10N2OMolecular weight: 162.192Synonyms: (2-Methyl-2H-indazol-7-yl)methanol|1159511-54-2|7-(Hydroxymethyl)-2-methyl-2H-indazole|(2-methylinda...SMILES: CN1C=C2C=CC=C(C2=N1)COInChIKey: ABKJWCWEXIJKDE-UHFFFAOYSA-NInChI: InChI=1S/C9H10N2O/c1-11-5-7-3-2-4-8(6-12)9(7)10-11/h2-5,12H,6H2,1H3
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7-Bromo-4-hydroxy-8-methylquinoline-3-carboxylic acid
Cas Number: 1189107-54-7Formula: C11H8BrNO3Molecular weight: 282.09Synonyms: 7-BROMO-8-METHYL-4-OXO-1H-QUINOLINE-3-CARBOXYLIC ACID | 7-Bromo-4-hydroxy-8-methylquinoline-3-carbox...SMILES: CC1=C(C=CC2=C1NC=C(C2=O)C(=O)O)BrInChIKey: CSCYIJACNBZKHZ-UHFFFAOYSA-NInChI: InChI=1S/C11H8BrNO3/c1-5-8(12)3-2-6-9(5)13-4-7(10(6)14)11(15)16/h2-4H,1H3,(H,13,14)(H,15,16)
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7-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one
Cas Number: 5755-05-5Formula: C9H8BrNO2Molecular weight: 242.072Synonyms: 7-Bromo-3,4-dihydrobenzo[f][1,4]oxazepin-5(2H)-one|5755-05-5|7-bromo-2,3,4,5-tetrahydro-1,4-benzoxaz...SMILES: C1COC2=C(C=C(C=C2)Br)C(=O)N1InChIKey: ZTPNIBLOOMKHQJ-UHFFFAOYSA-NInChI: InChI=1S/C9H8BrNO2/c10-6-1-2-8-7(5-6)9(12)11-3-4-13-8/h1-2,5H,3-4H2,(H,11,12)
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