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Search results for: '218600-44-3'
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2-Fluoro-5-methyl-3-nitropyridine
Cas Number: 19346-44-2Formula: C6H5FN2O2Molecular weight: 156.1Synonyms: 2-Fluoro-5-methyl-3-nitropyridine|19346-44-2|2-Fluoro-3-nitro-5-methylpyridine|Pyridine, 2-fluoro-5-...SMILES: CC1=CC(=C(N=C1)F)[N+](=O)[O-]InChIKey: MASVTBZQAKGYJA-UHFFFAOYSA-NInChI: InChI=1S/C6H5FN2O2/c1-4-2-5(9(10)11)6(7)8-3-4/h2-3H,1H3
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2-Butoxy-5-chloropyridine-3-boronic acid
Cas Number: 1217501-44-4Formula: C9H13BClNO3Molecular weight: 229.5Synonyms: 1217501-44-4|(2-Butoxy-5-chloropyridin-3-yl)boronic acid|2-BUTOXY-5-CHLOROPYRIDINE-3-BORONIC ACID|2-...SMILES: B(C1=CC(=CN=C1OCCCC)Cl)(O)OInChIKey: IRMURESJJOBLDM-UHFFFAOYSA-NInChI: InChI=1S/C9H13BClNO3/c1-2-3-4-15-9-8(10(13)14)5-7(11)6-12-9/h5-6,13-14H,2-4H2,1H3
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1,2-Dihydro-2-oxo-6-phenyl-4-(trifluoromethyl)3-pyridinecarbonitrile
Cas Number: 3335-44-2Formula: C13H7F3N2OMolecular weight: 264.2Synonyms: 3335-44-2|2-oxo-6-phenyl-4-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile|2-oxo-6-phenyl-4-(tr...SMILES: C1=CC=C(C=C1)C2=CC(=C(C(=O)N2)C#N)C(F)(F)FInChIKey: OOVASHBTYQTRFA-UHFFFAOYSA-NInChI: InChI=1S/C13H7F3N2O/c14-13(15,16)10-6-11(8-4-2-1-3-5-8)18-12(19)9(10)7-17/h1-6H,(H,18,19)
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Vinclozolin in Acetone
Cas Number: 50471-44-8 EC Number: 256-599-6Formula: C12H9Cl2NO3Molecular weight: 286.11Synonyms: VINCLOZOLIN|50471-44-8|Ronilan|Vinclozoline|Ornalin|Vorlan|Vinchlozoline|BAS 352 F|BAS 35204F|3-(3,5...SMILES: CC1(C(=O)N(C(=O)O1)C2=CC(=CC(=C2)Cl)Cl)C=CInChIKey: FSCWZHGZWWDELK-UHFFFAOYSA-NInChI: InChI=1S/C12H9Cl2NO3/c1-3-12(2)10(16)15(11(17)18-12)9-5-7(13)4-8(14)6-9/h3-6H,1H2,2H3
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Donafenib (Sorafenib D3)
Cas Number: 1130115-44-4Formula: C21H13D3ClF3N4O3Molecular weight: 467.84Synonyms: DTXSID90648995 | SCHEMBL3817 | s9621 | SCHEMBL14480690 | 2-Pyridinecarboxamide, 4-[4-[[[[4-chloro-3-...SMILES: CNC(=O)C1=NC=CC(=C1)OC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)FInChIKey: MLDQJTXFUGDVEO-FIBGUPNXSA-NInChI: InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)/i1D3
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cis-3-(propan-2-yloxy)cyclobutan-1-amine hydrochloride
Cas Number: 1909294-44-5Synonyms: cis-3-(propan-2-yloxy)cyclobutan-1-amine hydrochloride | 1909294-44-5 | 2227198-89-0 | trans-3-(prop...SMILES: CC(C)OC1CC(C1)N.ClInChIKey: RPDDGEKVYGRBKR-UHFFFAOYSA-NInChI: InChI=1S/C7H15NO.ClH/c1-5(2)9-7-3-6(8)4-7;/h5-7H,3-4,8H2,1-2H3;1H
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t-Boc-N-amido-PEG1-acid
Cas Number: 1260092-44-1Formula: C10H19NO5Molecular weight: 233.26Synonyms: AKOS028113549 | CS-0079142 | 1260092-44-1 | 3-(2-{[(tert-butoxy)carbonyl]amino}ethoxy)propanoic acid...SMILES: CC(C)(C)OC(=O)NCCOCCC(=O)OInChIKey: YGNSGMAPLOVGIU-UHFFFAOYSA-NInChI: InChI=1S/C10H19NO5/c1-10(2,3)16-9(14)11-5-7-15-6-4-8(12)13/h4-7H2,1-3H3,(H,11,14)(H,12,13)
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2-Amino-3-benzyloxy-5-bromopyrazine
Cas Number: 187973-44-0Formula: C11H10BrN3OMolecular weight: 280.1Synonyms: 187973-44-0|2-AMINO-3-BENZYLOXY-5-BROMOPYRAZINE|3-(benzyloxy)-5-bromopyrazin-2-amine|5-bromo-3-pheny...SMILES: C1=CC=C(C=C1)COC2=NC(=CN=C2N)BrInChIKey: FZVIPEDIQULQPK-UHFFFAOYSA-NInChI: InChI=1S/C11H10BrN3O/c12-9-6-14-10(13)11(15-9)16-7-8-4-2-1-3-5-8/h1-6H,7H2,(H2,13,14)
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WAY-605632
Cas Number: 53532-44-8Formula: C11H11ClN4OSMolecular weight: 282.75Synonyms: 1-(4-chlorophenyl)-3-(5-ethyl-1,3,4-thiadiazol-2-yl)urea|53532-44-8|CBMicro_006320|Oprea1_209448|MLS...SMILES: CCC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)ClInChIKey: WZAGORKCQNEQAY-UHFFFAOYSA-NInChI: InChI=1S/C11H11ClN4OS/c1-2-9-15-16-11(18-9)14-10(17)13-8-5-3-7(12)4-6-8/h3-6H,2H2,1H3,(H2,13,14,16,17)
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trans-3-amino-2,2,4,4-tetramethyl-cyclobutanol;hydrochloride
Cas Number: 13956-43-9Synonyms: 90226-44-1 | 13956-43-9 | 3-amino-2,2,4,4-tetramethylcyclobutan-1-ol hydrochloride | 3-Amino-2,2,4,4...SMILES: CC1(C(C(C1O)(C)C)N)C.ClInChIKey: YMBBKCTTZDWDRQ-UHFFFAOYSA-NInChI: InChI=1S/C8H17NO.ClH/c1-7(2)5(9)8(3,4)6(7)10;/h5-6,10H,9H2,1-4H3;1H
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2-(4-Methyl-3-nitrophenyl)acetic acid
Cas Number: 54941-44-5Formula: C9H9NO4Molecular weight: 195.17Synonyms: 54941-44-5|2-(4-Methyl-3-nitrophenyl)acetic acid|4-Methyl-3-nitrophenylacetic acid|3-nitro-4-methylp...SMILES: CC1=C(C=C(C=C1)CC(=O)O)[N+](=O)[O-]InChIKey: WZNKBDUWSKJHEG-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO4/c1-6-2-3-7(5-9(11)12)4-8(6)10(13)14/h2-4H,5H2,1H3,(H,11,12)
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Ethyl 5-cyclopropyl-1-methyl-1H-pyrazole-3-carboxylate
Cas Number: 1223748-44-4Formula: C10H14N2O2Molecular weight: 194.2Synonyms: ethyl 5-cyclopropyl-1-methyl-1H-pyrazole-3-carboxylate|1223748-44-4|ethyl 5-cyclopropyl-1-methylpyra...SMILES: CCOC(=O)C1=NN(C(=C1)C2CC2)CInChIKey: KLXROKKUWNRMEO-UHFFFAOYSA-NInChI: InChI=1S/C10H14N2O2/c1-3-14-10(13)8-6-9(7-4-5-7)12(2)11-8/h6-7H,3-5H2,1-2H3
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6-Fluoro-1H-indole-3-carboxylic acid
Cas Number: 23077-44-3Formula: C9H6FNO2Molecular weight: 179.15Synonyms: 6-fluoro-1H-indole-3-carboxylic acid|23077-44-3|6-Fluoroindole-3-carboxylic acid|1H-Indole-3-carboxy...SMILES: C1=CC2=C(C=C1F)NC=C2C(=O)OInChIKey: ITDFSNLFIZWJDB-UHFFFAOYSA-NInChI: InChI=1S/C9H6FNO2/c10-5-1-2-6-7(9(12)13)4-11-8(6)3-5/h1-4,11H,(H,12,13)
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5-ethyl-2-fluoro-4-[4-fluoro-3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-6-yl]phenol;dihydrochloride
Cas Number: 2247925-44-4Formula: C21H19N5OF2·2[HCl]Molecular weight: 468.33Synonyms: 2247925-44-4 | 5-ethyl-2-fluoro-4-[4-fluoro-3-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-...SMILES: CCC1=CC(=C(C=C1C2CC3C(C(C2)F)C(NN3)C4=NC5=C(N4)CNCC5)F)O.Cl.ClInChIKey: KBGIIKKONRQJNV-UHFFFAOYSA-NInChI: InChI=1S/C21H27F2N5O.2ClH/c1-2-10-7-18(29)13(22)8-12(10)11-5-14(23)19-16(6-11)27-28-20(19)21-25-15-3-4-24-9-17(15)26-21;;/h7-8,11,14,16,19-20,24,27-29H,2-6,9H2,1H3,(H,25,26);2*1H
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1-Nonen-3-ol
Cas Number: 21964-44-3Formula: C9H18OMolecular weight: 142.24Synonyms: 1-Nonen-3-ol|21964-44-3|Non-1-en-3-ol|Hexylvinylcarbinol|1-Vinylheptanol|delta1-nonen-3-ol|nonene-1-...SMILES: CCCCCCC(C=C)OInChIKey: DWUPJMHAPOQKGJ-UHFFFAOYSA-NInChI: InChI=1S/C9H18O/c1-3-5-6-7-8-9(10)4-2/h4,9-10H,2-3,5-8H2,1H3
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1-Methyl-3-(trifluoromethyl)-1H-pyrazol-4-amine
Cas Number: 1006436-44-7Formula: C5H6F3N3Molecular weight: 165.12Synonyms: 1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-amine|1006436-44-7|1-methyl-3-(trifluoromethyl)pyrazol-4-a...SMILES: CN1C=C(C(=N1)C(F)(F)F)NInChIKey: OHASPUNAEXVWEP-UHFFFAOYSA-NInChI: InChI=1S/C5H6F3N3/c1-11-2-3(9)4(10-11)5(6,7)8/h2H,9H2,1H3
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tert-butyl N-[trans-3-aminocyclopentyl]carbamate
Synonyms: 1009075-44-8|tert-Butyl ((1R,3R)-3-aminocyclopentyl)carbamate|tert-butyl n-[(1r,3r)-3-aminocyclopent...SMILES: CC(C)(C)OC(=O)NC1CCC(C1)NInChIKey: PGBVMVTUWHCOHX-HTQZYQBOSA-NInChI: InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-8-5-4-7(11)6-8/h7-8H,4-6,11H2,1-3H3,(H,12,13)/t7-,8-/m1/s1
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Ethyl 3-cyano-1H-pyrrole-2-carboxylate
Cas Number: 7126-44-5Formula: C8H8N2O2Molecular weight: 164.16Synonyms: ethyl 3-cyano-1H-pyrrole-2-carboxylate|7126-44-5|MFCD12756171|3-CYANO-1H-PYRROLE-2-CARBOXYLIC ACID E...SMILES: CCOC(=O)C1=C(C=CN1)C#NInChIKey: OSBMXQIJLZOLET-UHFFFAOYSA-NInChI: InChI=1S/C8H8N2O2/c1-2-12-8(11)7-6(5-9)3-4-10-7/h3-4,10H,2H2,1H3
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2-Methyl-2H-indazole-3-carboxylic acid
Cas Number: 34252-44-3Formula: C9H8N2O2Molecular weight: 176.17Synonyms: 2-Methyl-2H-indazole-3-carboxylic acid|34252-44-3|2-methylindazole-3-carboxylic Acid|2H-Indazole-3-c...SMILES: CN1C(=C2C=CC=CC2=N1)C(=O)OInChIKey: ABRISPFTOZIXMP-UHFFFAOYSA-NInChI: InChI=1S/C9H8N2O2/c1-11-8(9(12)13)6-4-2-3-5-7(6)10-11/h2-5H,1H3,(H,12,13)
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5-Amino-3-(fur-2-yl)isoxazole
Cas Number: 33866-44-3Formula: C7H6N2O2Molecular weight: 150.14Synonyms: 33866-44-3|3-(Furan-2-yl)isoxazol-5-amine|3-(2-furyl)isoxazol-5-amine|3-(furan-2-yl)-1,2-oxazol-5-am...SMILES: C1=COC(=C1)C2=NOC(=C2)NInChIKey: MKXZGFIJQYOAAA-UHFFFAOYSA-NInChI: InChI=1S/C7H6N2O2/c8-7-4-5(9-11-7)6-2-1-3-10-6/h1-4H,8H2
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4-Bromo-3-nitropyridine
Cas Number: 23056-44-2Formula: C5H3BrN2O2Molecular weight: 202.99Synonyms: 4-bromo-3-nitropyridine|23056-44-2|3-NITRO-4-BROMOPYRIDINE|Pyridine, 4-bromo-3-nitro-|MFCD04112576|S...SMILES: C1=CN=CC(=C1Br)[N+](=O)[O-]InChIKey: KVZNAGBWCCVHKG-UHFFFAOYSA-NInChI: InChI=1S/C5H3BrN2O2/c6-4-1-2-7-3-5(4)8(9)10/h1-3H
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2-Bromo-3-methoxyaniline
Cas Number: 112970-44-2Formula: C7H8BrNOMolecular weight: 202Synonyms: 2-Bromo-3-methoxyaniline|112970-44-2|2-bromo-3-aminoanisole|Benzenamine, 2-bromo-3-methoxy-|2-bromo-...SMILES: COC1=CC=CC(=C1Br)NInChIKey: TUNIZJPEKHLBPR-UHFFFAOYSA-NInChI: InChI=1S/C7H8BrNO/c1-10-6-4-2-3-5(9)7(6)8/h2-4H,9H2,1H3
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Food sweetener saccharin sodium solution reference material
Cas Number: 128-44-9Formula: C7H4NNaO3SMolecular weight: 205.17Synonyms: SACCHARIN SODIUM|128-44-9|Sodium 3-oxo-3H-benzo[d]isothiazol-2-ide 1,1-dioxide|Sodium saccharin|Sacc...SMILES: C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.[Na+]InChIKey: WINXNKPZLFISPD-UHFFFAOYSA-MInChI: InChI=1S/C7H5NO3S.Na/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h1-4H,(H,8,9);/q;+1/p-1
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UNC669
Cas Number: 1314241-44-5Formula: C15H20BrN3OMolecular weight: 338.24Synonyms: HMS3653O18 | NCGC00347957-09 | (5-bromopyridin-3-yl)(4-(pyrrolidin-1-yl)piperidin-1-yl)methanone | F...SMILES: C1CCN(C1)C2CCN(CC2)C(=O)C3=CC(=CN=C3)BrInChIKey: CQERVFFAOOUFEQ-UHFFFAOYSA-NInChI: InChI=1S/C15H20BrN3O/c16-13-9-12(10-17-11-13)15(20)19-7-3-14(4-8-19)18-5-1-2-6-18/h9-11,14H,1-8H2
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