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Search results for: '80441-57-2'
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6-Acetylthiohexanoic acid
Cas Number: 80441-57-2Formula: CH3COS(CH2)5CO2HMolecular weight: 190.26Synonyms: 6-Acetylthiohexanoic acid | SCHEMBL3330553 | Hexanoic acid, 6-(acetylthio)- | 6-Acetylthiohexanoic a...
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β-Propiolactone
Formula: C3H4O2Molecular weight: 72.06Synonyms: beta-propiolactone|2-Oxetanone|Propiolactone|57-57-8|Oxetan-2-one|Betaprone|Propanolide|3-Propanolid...SMILES: C1COC1=OInChIKey: VEZXCJBBBCKRPI-UHFFFAOYSA-NInChI: InChI=1S/C3H4O2/c4-3-1-2-5-3/h1-2H2
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Methyl 2-bromo-2-(3-methoxyphenyl)acetate
Cas Number: 86215-57-8Formula: C10H11BrO3Molecular weight: 259.097Synonyms: methyl 2-bromo-2-(3-methoxyphenyl)acetate|86215-57-8|77053-57-7|methyl2-bromo-2-(3-methoxyphenyl)ace...SMILES: COC1=CC=CC(=C1)C(C(=O)OC)BrInChIKey: YWMCHHGKDMGQPQ-UHFFFAOYSA-NInChI: InChI=1S/C10H11BrO3/c1-13-8-5-3-4-7(6-8)9(11)10(12)14-2/h3-6,9H,1-2H3
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BAY 57-1293, Helicase/primase inhibitor
Cas Number: 348086-71-5Formula: C18H18N4O3S2Molecular weight: 402.49Synonyms: Pritelivir|348086-71-5|BAY 57-1293|BAY-57-1293|AIC316|N-Methyl-N-(4-methyl-5-sulfamoylthiazol-2-yl)-...SMILES: CC1=C(SC(=N1)N(C)C(=O)CC2=CC=C(C=C2)C3=CC=CC=N3)S(=O)(=O)NInChIKey: IVZKZONQVYTCKC-UHFFFAOYSA-NInChI: InChI=1S/C18H18N4O3S2/c1-12-17(27(19,24)25)26-18(21-12)22(2)16(23)11-13-6-8-14(9-7-13)15-5-3-4-10-20-15/h3-10H,11H2,1-2H3,(H2,19,24,25)
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6-chloro-5-fluoro-2-iodo-pyridin-3-ol
Cas Number: 875548-57-5Formula: C5H2NOFClIMolecular weight: 273.43Synonyms: 6-chloro-5-fluoro-2-iodopyridin-3-ol | 875548-57-5 | SCHEMBL532736 | F89500SMILES: C1=C(C(=NC(=C1F)Cl)I)OInChIKey: ZVSAJKCQLAJFTJ-UHFFFAOYSA-NInChI: InChI=1S/C5H2ClFINO/c6-4-2(7)1-3(10)5(8)9-4/h1,10H
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(2R)-2-(tert-butoxycarbonylamino)-3-(3,3-difluorocyclobutyl)propanoic acid
Cas Number: 2198312-57-9Formula: C12H19NO4F2Molecular weight: 279.28Synonyms: E88389 | (2R)-2-(TERT-BUTOXYCARBONYLAMINO)-3-(3,3-DIFLUOROCYCLOBUTYL)PROPANOIC ACID | 2198312-57-9SMILES: CC(C)(C)OC(=O)NC(CC1CC(C1)(F)F)C(=O)OInChIKey: FZKXCGBTNRNDOX-MRVPVSSYSA-NInChI: InChI=1S/C12H19F2NO4/c1-11(2,3)19-10(18)15-8(9(16)17)4-7-5-12(13,14)6-7/h7-8H,4-6H2,1-3H3,(H,15,18)(H,16,17)/t8-/m1/s1
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6-bromo-3-fluoro-2-hydroxy-benzaldehyde
Cas Number: 1236079-57-4Formula: C7H4O2FBrMolecular weight: 219.01Synonyms: 6-Bromo-3-fluoro-2-hydroxybenzaldehyde | 1236079-57-4 | 6-Bromo-3-fluorosalicylaldehyde | MFCD226336...SMILES: C1=CC(=C(C(=C1F)O)C=O)BrInChIKey: HRNLFMAOPJHXEW-UHFFFAOYSA-NInChI: InChI=1S/C7H4BrFO2/c8-5-1-2-6(9)7(11)4(5)3-10/h1-3,11H
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6-bromothieno[3,2-b]pyridin-2-amine
Cas Number: 1638768-57-6Formula: C7H5BrN2SMolecular weight: 229.1Synonyms: 6-bromothieno[3,2-b]pyridin-2-amine | 1638768-57-6 | MFCD27987698 | SB14834 | AS-84572 | D79099SMILES: C1=C(C=NC2=C1SC(=C2)N)BrInChIKey: ZYZRSWYENLXTHO-UHFFFAOYSA-NInChI: InChI=1S/C7H5BrN2S/c8-4-1-6-5(10-3-4)2-7(9)11-6/h1-3H,9H2
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3-Iodo-2-methoxyisonicotinonitrile
Cas Number: 908279-57-2Formula: C7H5IN2OMolecular weight: 260.03Synonyms: 3-Iodo-2-methoxyisonicotinonitrile|908279-57-2|3-iodo-2-methoxypyridine-4-carbonitrile|DTXSID5047439...SMILES: COC1=NC=CC(=C1I)C#NInChIKey: NKOLCZUNZRIELF-UHFFFAOYSA-NInChI: InChI=1S/C7H5IN2O/c1-11-7-6(8)5(4-9)2-3-10-7/h2-3H,1H3
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4-bromo-2-chloro-5-(difluoromethyl)pyridine
Cas Number: 1471259-57-0Formula: C6H3NF2ClBrMolecular weight: 242.45Synonyms: SY322730 | 1471259-57-0 | MFCD25477654 | 4-bromo-2-chloro-5-(difluoromethyl)pyridine | DTXSID8012639...SMILES: C1=C(C(=CN=C1Cl)C(F)F)BrInChIKey: MBFJSZCQCIRFHR-UHFFFAOYSA-NInChI: InChI=1S/C6H3BrClF2N/c7-4-1-5(8)11-2-3(4)6(9)10/h1-2,6H
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Cysteamine Hydrochloride
Formula: C2H7NS•HClMolecular weight: 113.61Synonyms: Cysteamine hydrochloride|156-57-0|2-Aminoethanethiol hydrochloride|Cysteamine HCl|2-Mercaptoethylami...SMILES: C(CS)N.ClInChIKey: OGMADIBCHLQMIP-UHFFFAOYSA-NInChI: InChI=1S/C2H7NS.ClH/c3-1-2-4;/h4H,1-3H2;1H
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1-(5-Bromo-2-nitrophenyl)pyrrolidine
Cas Number: 1033201-57-8Formula: C10H11BrN2O2Molecular weight: 271.1Synonyms: 1-(5-BROMO-2-NITROPHENYL)PYRROLIDINE|1033201-57-8|4-bromo-2-(pyrrolidin-1-yl)nitrobenzene|SCHEMBL126...SMILES: C1CCN(C1)C2=C(C=CC(=C2)Br)[N+](=O)[O-]InChIKey: UAXQTHTZHXKTCH-UHFFFAOYSA-NInChI: InChI=1S/C10H11BrN2O2/c11-8-3-4-9(13(14)15)10(7-8)12-5-1-2-6-12/h3-4,7H,1-2,5-6H2
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3-bromo-[1,2,4]triazolo[4,3-a]pyrimidine
Cas Number: 1263286-57-2Formula: C5H3BrN4Molecular weight: 199.01Synonyms: 3-bromo-[1,2,4]triazolo[4,3-a]pyrimidine | 1263286-57-2 | MFCD17677033 | AKOS015902179 | AS-82473 | ...SMILES: C1=CN2C(=NN=C2Br)N=C1InChIKey: JKNZEQLPYXQMPQ-UHFFFAOYSA-NInChI: InChI=1S/C5H3BrN4/c6-4-8-9-5-7-2-1-3-10(4)5/h1-3H
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(2S)-2-(trifluoromethyl)pyrrolidine hydrochloride
Cas Number: 1410903-57-9Formula: C5H9ClF3NMolecular weight: 175.58Synonyms: 1410903-57-9 | (S)-2-(trifluoromethyl)pyrrolidine hydrochloride | (S)-2-Trifluoromethylpyrrolidine h...SMILES: C1CC(NC1)C(F)(F)F.ClInChIKey: UAKBWWZKKFYLRW-WCCKRBBISA-NInChI: InChI=1S/C5H8F3N.ClH/c6-5(7,8)4-2-1-3-9-4;/h4,9H,1-3H2;1H/t4-;/m0./s1
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1-Bromo-2-butoxy-4-fluorobenzene
Cas Number: 1036724-57-8Formula: C10H12BrFOMolecular weight: 247.1Synonyms: 1-Bromo-2-butoxy-4-fluorobenzene|1036724-57-8|SCHEMBL8297680|DTXSID90718349|MFCD18917783|1-Bromo-2-n...SMILES: CCCCOC1=C(C=CC(=C1)F)BrInChIKey: HXDXLVKJJHIJTR-UHFFFAOYSA-NInChI: InChI=1S/C10H12BrFO/c1-2-3-6-13-10-7-8(12)4-5-9(10)11/h4-5,7H,2-3,6H2,1H3
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2-chloro-6-cyclopropyl-pyridine-3-carboxamide
Cas Number: 1237954-57-2Formula: C9H9N2OClMolecular weight: 196.63Synonyms: 2-chloro-6-cyclopropyl-pyridine-3-carboxamide | 1237954-57-2 | 2-chloro-6-cyclopropylpyridine-3-carb...SMILES: C1CC1C2=NC(=C(C=C2)C(=O)N)ClInChIKey: WXEXHMUJLORCET-UHFFFAOYSA-NInChI: InChI=1S/C9H9ClN2O/c10-8-6(9(11)13)3-4-7(12-8)5-1-2-5/h3-5H,1-2H2,(H2,11,13)
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2-Nitro-5-(trifluoromethyl)benzaldehyde
Cas Number: 1176723-57-1Formula: C8H4F3NO3Molecular weight: 219.12Synonyms: 2-Nitro-5-(trifluoromethyl)benzaldehyde|1176723-57-1|SCHEMBL17802484|DTXSID60615811|GWFTUORCGNGELH-U...SMILES: C1=CC(=C(C=C1C(F)(F)F)C=O)[N+](=O)[O-]InChIKey: GWFTUORCGNGELH-UHFFFAOYSA-NInChI: InChI=1S/C8H4F3NO3/c9-8(10,11)6-1-2-7(12(14)15)5(3-6)4-13/h1-4H
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2-Methylmorpholine hydrochloride
Cas Number: 59229-57-1Formula: C5H12ClNOMolecular weight: 137.61Synonyms: 2-Methylmorpholine hydrochloride|59229-57-1|2-Methylmorpholine HCl|2-methylmorpholine;hydrochloride|...SMILES: CC1CNCCO1.ClInChIKey: PJYFXNZOOMGPIL-UHFFFAOYSA-NInChI: InChI=1S/C5H11NO.ClH/c1-5-4-6-2-3-7-5;/h5-6H,2-4H2,1H3;1H
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methyl 2-aminothiazolo[4,5-b]pyridine-5-carboxylate
Cas Number: 1206250-57-8Formula: C8H7N3O2SMolecular weight: 209.22Synonyms: 1206250-57-8 | thiazolo[4,5-b]pyridine-5-carboxylic acid,2-amino-,methyl ester | E88386 | METHYL 2-A...SMILES: COC(=O)C1=NC2=C(C=C1)SC(=N2)NInChIKey: DLWYTCMWXIOBHK-UHFFFAOYSA-NInChI: InChI=1S/C8H7N3O2S/c1-13-7(12)4-2-3-5-6(10-4)11-8(9)14-5/h2-3H,1H3,(H2,9,10,11)
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2,5-Difluorophenyl isothiocyanate
Cas Number: 206559-57-1Formula: C7H3F2NSMolecular weight: 171.17Synonyms: 2,5-Difluorophenyl isothiocyanate|206559-57-1|1,4-Difluoro-2-isothiocyanatobenzene|Benzene, 1,4-difl...SMILES: C1=CC(=C(C=C1F)N=C=S)FInChIKey: QVIDXDRFMDPVLA-UHFFFAOYSA-NInChI: InChI=1S/C7H3F2NS/c8-5-1-2-6(9)7(3-5)10-4-11/h1-3H
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Chlorobutanol
Cas Number: 57-15-8(DMSO)Formula: C4H7Cl3OMolecular weight: 177.46Synonyms: Chlorobutanol|57-15-8|Chlorbutol|CHLORETONE|1,1,1-trichloro-2-methylpropan-2-ol|Chloreton|1,1,1-Tric...SMILES: CC(C)(C(Cl)(Cl)Cl)OInChIKey: OSASVXMJTNOKOY-UHFFFAOYSA-NInChI: InChI=1S/C4H7Cl3O/c1-3(2,8)4(5,6)7/h8H,1-2H3
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N-Cyclopropyl-2,3-difluoro-6-nitroaniline
Cas Number: 1249882-57-2Formula: C9H8F2N2O2Molecular weight: 214.2Synonyms: N-Cyclopropyl-2,3-difluoro-6-nitroaniline|1249882-57-2|SCHEMBL20337755|DTXSID00734419|ZZB88257|MFCD1...SMILES: C1CC1NC2=C(C=CC(=C2F)F)[N+](=O)[O-]InChIKey: ZJCMNSWNFKRDHG-UHFFFAOYSA-NInChI: InChI=1S/C9H8F2N2O2/c10-6-3-4-7(13(14)15)9(8(6)11)12-5-1-2-5/h3-5,12H,1-2H2
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(S)-Oxetan-2-ylmethanamine
Cas Number: 2091328-57-1 EC Number: 871-439-0Formula: C4H9NOMolecular weight: 87.12Synonyms: PS-17260 | CS-0100100 | P20441 | MFCD31727897 | [(2S)-oxetan-2-yl]methanamine | 2091328-57-1 | EN300...SMILES: C1COC1CNInChIKey: QDEFNAHLCTUWAH-BYPYZUCNSA-NInChI: InChI=1S/C4H9NO/c5-3-4-1-2-6-4/h4H,1-3,5H2/t4-/m0/s1
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2-Propylphenyl isocyanate
Cas Number: 190774-57-3Formula: C10H11NOMolecular weight: 161.2Synonyms: 2-Propylphenyl isocyanate|190774-57-3|1-isocyanato-2-propylbenzene|2-Propylphenylisocyanate|2-n-Prop...SMILES: CCCC1=CC=CC=C1N=C=OInChIKey: NSGTVMQTRFUUSL-UHFFFAOYSA-NInChI: InChI=1S/C10H11NO/c1-2-5-9-6-3-4-7-10(9)11-8-12/h3-4,6-7H,2,5H2,1H3
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