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Search results for: '120-54-7'
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Dipentamethylenethiuram Tetrasulfide
Cas Number: 120-54-7Formula: C12H20N2S6Molecular weight: 384.69Synonyms: Dipentamethylenethiuram tetrasulfide ('so called' vulcaniZation accelerator) | VNDRMZTXEFFQDR-UHFFFA...SMILES: C1CCN(CC1)C(=S)SSSSC(=S)N2CCCCC2InChIKey: VNDRMZTXEFFQDR-UHFFFAOYSA-NInChI: InChI=1S/C12H20N2S6/c15-11(13-7-3-1-4-8-13)17-19-20-18-12(16)14-9-5-2-6-10-14/h1-10H2
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Anthracene
Formula: C14H10Molecular weight: 178.23Synonyms: EINECS 204-371-1 | EN300-18023 | Tetra Olive N2G | 331481_ALDRICH | acenes | A804437 | AKOS000119970...SMILES: C1=CC=C2C=C3C=CC=CC3=CC2=C1InChIKey: MWPLVEDNUUSJAV-UHFFFAOYSA-NInChI: InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H
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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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4-ETHOXY-3-METHOXYPHENYLACETIC ACID
Cas Number: 120-13-8Formula: C11H14O4Molecular weight: 210.232Synonyms: 4-Ethoxy-3-methoxyphenylacetic acid|120-13-8|2-(4-ethoxy-3-methoxyphenyl)acetic acid|(4-ethoxy-3-met...SMILES: CCOC1=C(C=C(C=C1)CC(=O)O)OCInChIKey: XVNXRPVJRCYHEW-UHFFFAOYSA-NInChI: InChI=1S/C11H14O4/c1-3-15-9-5-4-8(7-11(12)13)6-10(9)14-2/h4-6H,3,7H2,1-2H3,(H,12,13)
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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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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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4-Chloro-7-methoxyquinazolin-6-yl acetate hydrochloride
Cas Number: 179688-54-1Formula: C11H10Cl2N2O3Molecular weight: 289.12Synonyms: 179688-54-1|4-Chloro-7-methoxyquinazolin-6-yl acetate hydrochloride|4-Chloro-6-acetoxy-7-methoxyquin...SMILES: CC(=O)OC1=C(C=C2C(=C1)C(=NC=N2)Cl)OC.ClInChIKey: DSYIUUXIRMLRQU-UHFFFAOYSA-NInChI: InChI=1S/C11H9ClN2O3.ClH/c1-6(15)17-10-3-7-8(4-9(10)16-2)13-5-14-11(7)12;/h3-5H,1-2H3;1H
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7-bromo-4-fluoro-1-benzofuran-5-carboxylic acid
Cas Number: 2227206-54-2Formula: C9H4BrFO3Molecular weight: 259.03Synonyms: P20038 | 7-Bromo-4-fluorobenzofuran-5-carboxylic Acid | 5-Benzofurancarboxylic acid, 7-bromo-4-fluor...SMILES: C1=COC2=C(C=C(C(=C21)F)C(=O)O)BrInChIKey: LRLWRVKUGNQOAY-UHFFFAOYSA-NInChI: InChI=1S/C9H4BrFO3/c10-6-3-5(9(12)13)7(11)4-1-2-14-8(4)6/h1-3H,(H,12,13)
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7-Methylimidazo[1,2-a]pyridine-2-carbaldehyde
Cas Number: 202348-54-7Formula: C9H8N2OMolecular weight: 160.2Synonyms: 7-Methylimidazo[1,2-a]pyridine-2-carbaldehyde|202348-54-7|Imidazo[1,2-a]pyridine-2-carboxaldehyde, 7...SMILES: CC1=CC2=NC(=CN2C=C1)C=OInChIKey: AETJTTLBDVLRJO-UHFFFAOYSA-NInChI: InChI=1S/C9H8N2O/c1-7-2-3-11-5-8(6-12)10-9(11)4-7/h2-6H,1H3
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6-chloro-5-methoxypyridin-3-ol
Cas Number: 1105933-54-7Formula: C6H6ClNO2Molecular weight: 159.57Synonyms: 6-chloro-5-methoxypyridin-3-ol | 1105933-54-7 | 2-Chloro-5-hydroxy-3-methoxypyridine | SCHEMBL741230...SMILES: COC1=C(N=CC(=C1)O)ClInChIKey: BDRZASDJWOUJSZ-UHFFFAOYSA-NInChI: InChI=1S/C6H6ClNO2/c1-10-5-2-4(9)3-8-6(5)7/h2-3,9H,1H3
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ethyl 7-chloropyrazolo[1,5-a]pyrimidine-3-carboxylate
Cas Number: 749216-54-4Formula: C9H8ClN3O2Molecular weight: 225.63Synonyms: ethyl 7-chloropyrazolo[1,5-a]pyrimidine-3-carboxylate|749216-54-4|Ethyl 7-chloropyrazolo-[1,5-a]pyri...SMILES: CCOC(=O)C1=C2N=CC=C(N2N=C1)ClInChIKey: AAZUFGGEDDFFOB-UHFFFAOYSA-NInChI: InChI=1S/C9H8ClN3O2/c1-2-15-9(14)6-5-12-13-7(10)3-4-11-8(6)13/h3-5H,2H2,1H3
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methyl 5-oxo-7-(trifluoromethylsulfonyloxy)-2,3-dihydro-1H-indolizine-3-carboxylate
Cas Number: 1956310-54-5Formula: C11H10NO6F3SMolecular weight: 341.26Synonyms: 1956310-54-5 | Methyl 5-oxo-7-(((trifluoromethyl)sulfonyl)oxy)-1,2,3,5-tetrahydroindolizine-3-carbox...SMILES: COC(=O)C1CCC2=CC(=CC(=O)N12)OS(=O)(=O)C(F)(F)FInChIKey: UAKUKEWEPLTYNL-UHFFFAOYSA-NInChI: InChI=1S/C11H10F3NO6S/c1-20-10(17)8-3-2-6-4-7(5-9(16)15(6)8)21-22(18,19)11(12,13)14/h4-5,8H,2-3H2,1H3
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tert-butyl 10-oxo-3-oxa-7,9-diazabicyclo[3.3.2]decane-7-carboxylate
Cas Number: 1160248-54-3Formula: C12H20N2O4Molecular weight: 256.3Synonyms: TERT-BUTYL 10-OXO-3-OXA-7,9-DIAZABICYCLO[3.3.2]DECANE-7-CARBOXYLATE | 1160248-54-3 | AM805479 | CS-0...SMILES: CC(C)(C)OC(=O)N1CC2COCC(C1)NC2=OInChIKey: BAFSZFFNJNSJOE-UHFFFAOYSA-NInChI: InChI=1S/C12H20N2O4/c1-12(2,3)18-11(16)14-4-8-6-17-7-9(5-14)13-10(8)15/h8-9H,4-7H2,1-3H3,(H,13,15)
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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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cis-2-phenylcyclobutane-1-carboxylic acid
Cas Number: 87442-58-8Formula: C11H12O2Molecular weight: 176.22Synonyms: cis-2-phenylcyclobutane-1-carboxylic acid | 87442-58-8 | (1S,2R)-2-Phenylcyclobutanecarboxylic acid ...SMILES: C1CC(C1C2=CC=CC=C2)C(=O)OInChIKey: NYTUABLWSVGNGV-UWVGGRQHSA-NInChI: InChI=1S/C11H12O2/c12-11(13)10-7-6-9(10)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,12,13)/t9-,10-/m0/s1
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