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Search results for: '201595-71-3'
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Sodium L-lactate-(¹³C)3
Cas Number: 201595-71-3Formula: 13CH313CH(OH)13CO2NaMolecular weight: 115.04Synonyms: Sodium L-lactate-(¹³-C)3 | AKOS025294843 | Sodium (S)-2-hydroxypropanoic-(¹³-C)3 | J-013071 | So...SMILES: CC(C(=O)[O-])O.[Na+]InChIKey: NGSFWBMYFKHRBD-USULVYIHSA-MInChI: InChI=1S/C3H6O3.Na/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6);/q;+1/p-1/t2-;/m0./s1/i1+1,2+1,3+1;
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PU-H71
Cas Number: 873436-91-0Formula: C18H21IN6O2SMolecular weight: 512.37Synonyms: PU-H71|873436-91-0|Zelavespib|PU-H 71|PU H71|PUH-71|PU-H-71|8-((6-Iodobenzo[d][1,3]dioxol-5-yl)thio)...SMILES: CC(C)NCCCN1C2=NC=NC(=C2N=C1SC3=C(C=C4C(=C3)OCO4)I)NInChIKey: SUPVGFZUWFMATN-UHFFFAOYSA-NInChI: InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23)
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Pyridaben in Methanol
Cas Number: 96489-71-3 EC Number: 405-700-3Formula: C19H25ClN2OSMolecular weight: 364.93Synonyms: CAS-96489-71-3 | Pyramite | 2-t-butyl-5-(p-t-butylbenzylthio)-4-chloro-3(2H)-pyridazinone | AKOS0158...SMILES: CC(C)(C)C1=CC=C(C=C1)CSC2=C(C(=O)N(N=C2)C(C)(C)C)ClInChIKey: DWFZBUWUXWZWKD-UHFFFAOYSA-NInChI: InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3
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PU-H71 XHBr
Cas Number: 873436-91-0(free)Formula: C18H21IN6O2S XHBrMolecular weight: 512.37(free)Synonyms: PU-H71|873436-91-0|Zelavespib|PU-H 71|PU H71|PUH-71|PU-H-71|8-((6-Iodobenzo[d][1,3]dioxol-5-yl)thio)...SMILES: CC(C)NCCCN1C2=NC=NC(=C2N=C1SC3=C(C=C4C(=C3)OCO4)I)NInChIKey: SUPVGFZUWFMATN-UHFFFAOYSA-NInChI: InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23)
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bicyclo[3.1.1]heptan-3-amine hydrochloride
Cas Number: 2306261-71-0Synonyms: bicyclo[3.1.1]heptan-3-amine hydrochloride | 2306261-71-0 | Bicyclo[3.1.1]heptan-3-amine HCl | PB422...SMILES: C1C2CC1CC(C2)N.ClInChIKey: KNYVRNZCCQCFKA-UHFFFAOYSA-NInChI: InChI=1S/C7H13N.ClH/c8-7-3-5-1-6(2-5)4-7;/h5-7H,1-4,8H2;1H
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3-Acetylphenyl isothiocyanate
Cas Number: 3125-71-1Formula: C9H7NOSMolecular weight: 177.23Synonyms: 3-Acetylphenyl Isothiocyanate|3125-71-1|1-(3-Isothiocyanatophenyl)ethanone|3-Acetylphenylisothiocyan...SMILES: CC(=O)C1=CC(=CC=C1)N=C=SInChIKey: RGANVWCPAAIVNN-UHFFFAOYSA-NInChI: InChI=1S/C9H7NOS/c1-7(11)8-3-2-4-9(5-8)10-6-12/h2-5H,1H3
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3,5-Bis(3-nitrophenyl)-1,2,4-oxadiazole
Cas Number: 74229-71-3Formula: C14H8N4O5Molecular weight: 312.2Synonyms: 3,5-bis(3-nitrophenyl)-1,2,4-oxadiazole|74229-71-3|DTXSID20362915|ZCA22971|MFCD01624374|STK321442|AK...SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C2=NOC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]InChIKey: DLOMOIFOKNNPRG-UHFFFAOYSA-NInChI: InChI=1S/C14H8N4O5/c19-17(20)11-5-1-3-9(7-11)13-15-14(23-16-13)10-4-2-6-12(8-10)18(21)22/h1-8H
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3-iodo-1-methyl-1H-pyrrolo[2,3-b]pyridine
Cas Number: 260431-71-8Formula: C8H7IN2Molecular weight: 258.06Synonyms: 3-iodo-1-methyl-1H-pyrrolo[2,3-b]pyridine | 260431-71-8 | SCHEMBL14197833 | MFCD18254000 | SB14168 |...SMILES: CN1C=C(C2=C1N=CC=C2)IInChIKey: AWSQFYGAAAQKFU-UHFFFAOYSA-NInChI: InChI=1S/C8H7IN2/c1-11-5-7(9)6-3-2-4-10-8(6)11/h2-5H,1H3
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BMS-986124, Allosteric modulator of μ receptor
Synonyms: BMS-986124|GTPL9160|SCHEMBL24685774|AKOS040748026|Q27075386|2-(4-bromo-2-methoxyphenyl)-3-(4-chlorob...SMILES: COc1cc(Br)ccc1C1SCCN1S(=O)(=O)c1ccc(cc1)ClInChIKey: PMPBBWPDHSHENJ-UHFFFAOYSA-NInChI: InChI=1S/C16H15BrClNO3S2/c1-22-15-10-11(17)2-7-14(15)16-19(8-9-23-16)24(20,21)13-5-3-12(18)4-6-13/h2-7,10,16H,8-9H2,1H3
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3-Amino-1-methanesulfonylpyrrolidine
Cas Number: 662116-71-4Formula: C5H12N2O2SMolecular weight: 164.2Synonyms: 3-AMINO-1-METHANESULFONYLPYRROLIDINE|662116-71-4|1-(METHYLSULFONYL)PYRROLIDIN-3-AMINE|1-methylsulfon...SMILES: CS(=O)(=O)N1CCC(C1)NInChIKey: UDYSDVVJHGYAHB-UHFFFAOYSA-NInChI: InChI=1S/C5H12N2O2S/c1-10(8,9)7-3-2-5(6)4-7/h5H,2-4,6H2,1H3
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3-(3-Methoxyphenyl)propionic acid
Cas Number: 10516-71-9Formula: C10H12O3Molecular weight: 180.2Synonyms: 3-(3-Methoxyphenyl)propionic acid|10516-71-9|3-(3-Methoxyphenyl)propanoic acid|3-Methoxybenzenepropa...SMILES: COC1=CC=CC(=C1)CCC(=O)OInChIKey: BJJQJLOZWBZEGA-UHFFFAOYSA-NInChI: InChI=1S/C10H12O3/c1-13-9-4-2-3-8(7-9)5-6-10(11)12/h2-4,7H,5-6H2,1H3,(H,11,12)
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3-Thiophenesulfonyl chloride
Cas Number: 51175-71-4Formula: C4H3ClO2S2Molecular weight: 182.6Synonyms: Thiophene-3-sulfonyl Chloride|51175-71-4|3-THIOPHENESULFONYL CHLORIDE|3-ThiophenesulfonylChloride|Th...SMILES: C1=CSC=C1S(=O)(=O)ClInChIKey: YSPWSQNKRBSICH-UHFFFAOYSA-NInChI: InChI=1S/C4H3ClO2S2/c5-9(6,7)4-1-2-8-3-4/h1-3H
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3-Bromo-5-(methylsulfonyl)pyridine
Cas Number: 445491-71-4Formula: C6H6BrNO2SMolecular weight: 236.1Synonyms: 3-Bromo-5-(methylsulfonyl)pyridine|445491-71-4|3-Bromo-5-methylsulfonylpyridine|3-bromo-5-methanesul...SMILES: CS(=O)(=O)C1=CC(=CN=C1)BrInChIKey: CNAIMMQZMLBREW-UHFFFAOYSA-NInChI: InChI=1S/C6H6BrNO2S/c1-11(9,10)6-2-5(7)3-8-4-6/h2-4H,1H3
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3-(trifluoromethyl)-8-azabicyclo[3.2.1]octan-3-ol;hydrochloride
Cas Number: 2649011-71-0 EC Number: 953-447-7Synonyms: 3-(trifluoromethyl)-8-azabicyclo[3.2.1]octan-3-ol hydrochloride | 2649011-71-0 | SCHEMBL3714004 | AT...SMILES: C1CC2CC(CC1N2)(C(F)(F)F)O.ClInChIKey: NFENMLACPWMHEQ-UHFFFAOYSA-NInChI: InChI=1S/C8H12F3NO.ClH/c9-8(10,11)7(13)3-5-1-2-6(4-7)12-5;/h5-6,12-13H,1-4H2;1H
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3-Chloro-4-ethynylpyridine
Cas Number: 1196156-71-4Formula: C7H4ClNMolecular weight: 137.6Synonyms: 3-chloro-4-ethynylpyridine|1196156-71-4|1379109-40-6|SCHEMBL5700051|DTXSID20634109|WXB15671|MFCD1318...SMILES: C#CC1=C(C=NC=C1)ClInChIKey: HBIXKYZHQNPYGN-UHFFFAOYSA-NInChI: InChI=1S/C7H4ClN/c1-2-6-3-4-9-5-7(6)8/h1,3-5H
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3-Bromo-2-(trifluoromethyl)aniline
Cas Number: 244246-71-7Formula: C7H5BrF3NMolecular weight: 240Synonyms: 3-Bromo-2-(trifluoromethyl)aniline|244246-71-7|MFCD13194482|Benzenamine, 3-bromo-2-(trifluoromethyl)...SMILES: C1=CC(=C(C(=C1)Br)C(F)(F)F)NInChIKey: DAXMSIHFYZSWNH-UHFFFAOYSA-NInChI: InChI=1S/C7H5BrF3N/c8-4-2-1-3-5(12)6(4)7(9,10)11/h1-3H,12H2
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methyl 5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylate;dihydrochloride
Cas Number: 2551116-71-1Formula: C10H14Cl2N2O2Molecular weight: 265.13Synonyms: 2551116-71-1 | Methyl 5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylate | dihydrochloride | Methyl ...SMILES: COC(=O)C1=CC2=C(CNCC2)N=C1.Cl.ClInChIKey: OWFPEZOBUWMJEM-UHFFFAOYSA-NInChI: InChI=1S/C10H12N2O2.2ClH/c1-14-10(13)8-4-7-2-3-11-6-9(7)12-5-8;;/h4-5,11H,2-3,6H2,1H3;2*1H
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(2S,3S)-1-benzhydryl-2-methyl-azetidin-3-amine
Cas Number: 164906-71-2Formula: C17H20N2Molecular weight: 252.35Synonyms: (2S,3S)-1-benzhydryl-2-methyl-azetidin-3-amine | 164906-71-2 | (2S,3S)-1-benzhydryl-2-methylazetidin...SMILES: CC1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)NInChIKey: CJCQBRZYAQTEOO-BBRMVZONSA-NInChI: InChI=1S/C17H20N2/c1-13-16(18)12-19(13)17(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16-17H,12,18H2,1H3/t13-,16-/m0/s1
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trans-3-chlorocyclobutane-1-carboxylic acid
Synonyms: 3-chlorocyclobutanecarboxylic acid|35207-71-7|trans-3-Chlorocyclobutanecarboxylic acid|3-CHLOROCYCLO...SMILES: C1C(CC1Cl)C(=O)OInChIKey: UJPLLCVUUMDULO-UHFFFAOYSA-NInChI: InChI=1S/C5H7ClO2/c6-4-1-3(2-4)5(7)8/h3-4H,1-2H2,(H,7,8)
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tert-butyl 3-ethynyl-3-methylpyrrolidine-1-carboxylate
Cas Number: 2168736-71-6Formula: C12H19NO2Molecular weight: 209.29Synonyms: tert-Butyl 3-ethynyl-3-methylpyrrolidine-1-carboxylate | 2168736-71-6 | SCHEMBL22088545 | 1-Boc-3-et...SMILES: CC1(CCN(C1)C(=O)OC(C)(C)C)C#CInChIKey: XABXFOQDOYKTHU-UHFFFAOYSA-NInChI: InChI=1S/C12H19NO2/c1-6-12(5)7-8-13(9-12)10(14)15-11(2,3)4/h1H,7-9H2,2-5H3
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tert-butyl 3-methylidenepyrrolidine-1-carboxylate
Cas Number: 114214-71-0Formula: C10H17NO2Molecular weight: 183.251Synonyms: 114214-71-0|tert-butyl 3-methylenepyrrolidine-1-carboxylate|tert-butyl 3-methylidenepyrrolidine-1-ca...SMILES: CC(C)(C)OC(=O)N1CCC(=C)C1InChIKey: PXTONRTYYUAUJU-UHFFFAOYSA-NInChI: InChI=1S/C10H17NO2/c1-8-5-6-11(7-8)9(12)13-10(2,3)4/h1,5-7H2,2-4H3
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N-(3-Chloropropyl) 4-bromobenzenesulfonamide
Cas Number: 98768-71-9Formula: C9H11BrClNO2SMolecular weight: 312.6Synonyms: 98768-71-9|4-bromo-N-(3-chloropropyl)benzenesulfonamide|N-(3-Chloropropyl) 4-bromobenzenesulfonamide...SMILES: C1=CC(=CC=C1S(=O)(=O)NCCCCl)BrInChIKey: RSRQIXOUDJOCFX-UHFFFAOYSA-NInChI: InChI=1S/C9H11BrClNO2S/c10-8-2-4-9(5-3-8)15(13,14)12-7-1-6-11/h2-5,12H,1,6-7H2
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2-Ethoxynicotinonitrile
Cas Number: 14248-71-6Formula: C8H8N2OMolecular weight: 148.2Synonyms: 2-ethoxynicotinonitrile|14248-71-6|2-ethoxypyridine-3-carbonitrile|2-ETHOXYNICOTINONITRILE 98per cen...SMILES: CCOC1=C(C=CC=N1)C#NInChIKey: NJQMOOHWTMTWLP-UHFFFAOYSA-NInChI: InChI=1S/C8H8N2O/c1-2-11-8-7(6-9)4-3-5-10-8/h3-5H,2H2,1H3
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