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Search results for: '21(3/4)4544'
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7-chloro-3-oxo-8-(1,3-thiazol-5-ylmethylamino)-11,16-dioxa-2,4,19,21-tetrazatricyclo[15.3.1.05,10]henicosa-1(20),5,7,9,17(21),18-hexaene-18-carbonitrile, Inhibitor of checkpoint kinase 1;Inhibitor of fms related receptor tyrosine kinase 1;Inhibitor of muscle associated receptor tyrosine kinase;Inhibitor of nemo like kinase;Inhibitor of NIMA related kinase 11;Inhibitor of NIMA related kinase 3;Inhibitor of
Synonyms: compound 25SMILES: N#Cc1ncc2nc1OCCCCOc1c(NC(=O)N2)cc(Cl)c(c1)NCc1cncs1InChIKey: AZTMYWWWILJAKW-UHFFFAOYSA-NInChI: InChI=1S/C20H18ClN7O3S/c21-13-5-15-17(6-14(13)24-9-12-8-23-11-32-12)30-3-1-2-4-31-19-16(7-22)25-10-18(27-19)28-20(29)26-15/h5-6,8,10-11,24H,1-4,9H2,(H2,26,27,28,29)
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4-(3-Benzyloxyphenyl)-3-fluorobenzoic acid
Cas Number: 1261912-21-3Formula: C20H15FO3Molecular weight: 322.3Synonyms: 1261912-21-3|3'-(Benzyloxy)-2-fluoro-[1,1'-biphenyl]-4-carboxylic acid|4-(3-BENZYLOXYPHENYL)-3-FLUOR...SMILES: C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=C(C=C(C=C3)C(=O)O)FInChIKey: MLUFTTSUDFBEAM-UHFFFAOYSA-NInChI: InChI=1S/C20H15FO3/c21-19-12-16(20(22)23)9-10-18(19)15-7-4-8-17(11-15)24-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,22,23)
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(3R,4S)-4-(4-(Benzyloxy)phenyl)-1-(4-fluorophenyl)-3-(3-(4-fluorophenyl)-3-oxopropyl)azetidin-2-one
Cas Number: 190595-65-4Formula: C31H25F2NO3Molecular weight: 497.53Synonyms: (3R,4S)-1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxopropyl]-4-(4-phenylmethoxyphenyl)azetidin-2-on...SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)C3C(C(=O)N3C4=CC=C(C=C4)F)CCC(=O)C5=CC=C(C=C5)FInChIKey: BVYNXBNCXPJQCW-PQHLKRTFSA-NInChI: InChI=1S/C31H25F2NO3/c32-24-10-6-22(7-11-24)29(35)19-18-28-30(34(31(28)36)26-14-12-25(33)13-15-26)23-8-16-27(17-9-23)37-20-21-4-2-1-3-5-21/h1-17,28,30H,18-20H2/t28-,30-/m1/s1
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4-Amino-3-bromo-5-nitrobenzamide
Cas Number: 1355247-21-0Formula: C7H6BrN3O3Molecular weight: 260Synonyms: 4-Amino-3-bromo-5-nitrobenzamide|1355247-21-0|DTXSID20742758|MFCD21332917|AKOS016001187|BS-25603|CS-...SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)C(=O)NInChIKey: LWMPRBCMKLSQEP-UHFFFAOYSA-NInChI: InChI=1S/C7H6BrN3O3/c8-4-1-3(7(10)12)2-5(6(4)9)11(13)14/h1-2H,9H2,(H2,10,12)
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4-[3-Chloro-4-(3-fluorobenzyloxy)phenylamino]-6-iodoquinazoline
Cas Number: 231278-20-9 EC Number: 607-200-2Formula: C21H14ClFIN3OMolecular weight: 505.72Synonyms: MFCD09998827 | n-(3-chloro-4-(3-fluorobenzyloxy)phenyl)-6-iodoquinazolin-4-amine | N-[3-chloro-4-[(3...SMILES: C1=CC(=CC(=C1)F)COC2=C(C=C(C=C2)NC3=NC=NC4=C3C=C(C=C4)I)ClInChIKey: UHFPFDMMKYQMLC-UHFFFAOYSA-NInChI: InChI=1S/C21H14ClFIN3O/c22-18-10-16(5-7-20(18)28-11-13-2-1-3-14(23)8-13)27-21-17-9-15(24)4-6-19(17)25-12-26-21/h1-10,12H,11H2,(H,25,26,27)
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4-(3'-Chlorobenzyloxy)-3,5-dimethylphenylboronic acid
Cas Number: 849062-21-1Formula: C15H16BClO3Molecular weight: 290.55Synonyms: 849062-21-1|4-(3'-Chlorobenzyloxy)-3,5-dimethylphenylboronic acid|(4-((3-Chlorobenzyl)oxy)-3,5-dimet...SMILES: B(C1=CC(=C(C(=C1)C)OCC2=CC(=CC=C2)Cl)C)(O)OInChIKey: FSGQMHRYHYNMCX-UHFFFAOYSA-NInChI: InChI=1S/C15H16BClO3/c1-10-6-13(16(18)19)7-11(2)15(10)20-9-12-4-3-5-14(17)8-12/h3-8,18-19H,9H2,1-2H3
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4-Amino-3-methylbenzonitrile
Cas Number: 78881-21-7Formula: C8H8N2Molecular weight: 132.17Synonyms: 4-Amino-3-methylbenzonitrile|78881-21-7|4-Cyano-o-toluidine|2-Amino-5-cyanotoluene|4-Cyano-2-methyla...SMILES: CC1=C(C=CC(=C1)C#N)NInChIKey: MBZDCUMFFPWLTJ-UHFFFAOYSA-NInChI: InChI=1S/C8H8N2/c1-6-4-7(5-9)2-3-8(6)10/h2-4H,10H2,1H3
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4-Fluoro-3-(isopropylcarbamoyl)phenylboronic acid
Cas Number: 874219-21-3Formula: C10H13BFNO3Molecular weight: 225Synonyms: 874219-21-3|4-Fluoro-3-(isopropylcarbamoyl)phenylboronic acid|(4-Fluoro-3-(isopropylcarbamoyl)phenyl...SMILES: B(C1=CC(=C(C=C1)F)C(=O)NC(C)C)(O)OInChIKey: KPQHVEASBVESSL-UHFFFAOYSA-NInChI: InChI=1S/C10H13BFNO3/c1-6(2)13-10(14)8-5-7(11(15)16)3-4-9(8)12/h3-6,15-16H,1-2H3,(H,13,14)
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2',3',4',5'-Tetrafluoroacetophenone
Cas Number: 66286-21-3Formula: C8H4F4OMolecular weight: 192.11Synonyms: 66286-21-3|1-(2,3,4,5-tetrafluorophenyl)ethanone|2',3',4',5'-Tetrafluoroacetophenone|2',3',4',5'-Ter...SMILES: CC(=O)C1=CC(=C(C(=C1F)F)F)FInChIKey: JYKCLBMVRLLJCI-UHFFFAOYSA-NInChI: InChI=1S/C8H4F4O/c1-3(13)4-2-5(9)7(11)8(12)6(4)10/h2H,1H3
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(4-Bromo-3-methylphenylcarbonyl)pyrrolidine
Cas Number: 149105-15-7Formula: C12H14BrNOMolecular weight: 268.2Synonyms: 149105-15-7|(4-BROMO-3-METHYLPHENYLCARBONYL)PYRROLIDINE|(4-Bromo-3-methylphenyl)(pyrrolidin-1-yl)met...SMILES: CC1=C(C=CC(=C1)C(=O)N2CCCC2)BrInChIKey: RCAQDBSEMTZVRD-UHFFFAOYSA-NInChI: InChI=1S/C12H14BrNO/c1-9-8-10(4-5-11(9)13)12(15)14-6-2-3-7-14/h4-5,8H,2-3,6-7H2,1H3
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4-Bromo-3-chloro-6-nitroanisole
Cas Number: 917562-21-1Formula: C7H5BrClNO3Molecular weight: 266.5Synonyms: 917562-21-1|1-Bromo-2-chloro-4-methoxy-5-nitrobenzene|4-Bromo-3-chloro-6-nitroanisole|4-?Bromo-?3-?c...SMILES: COC1=CC(=C(C=C1[N+](=O)[O-])Br)ClInChIKey: CLOMPIIPEQKLRX-UHFFFAOYSA-NInChI: InChI=1S/C7H5BrClNO3/c1-13-7-3-5(9)4(8)2-6(7)10(11)12/h2-3H,1H3
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3-Methyl-5-phenylisoxazole-4-carboxylic acid
Cas Number: 17153-21-8Formula: C11H9NO3Molecular weight: 203.19Synonyms: 3-methyl-5-phenylisoxazole-4-carboxylic acid|17153-21-8|3-methyl-5-phenyl-4-isoxazolecarboxylic acid...SMILES: CC1=NOC(=C1C(=O)O)C2=CC=CC=C2InChIKey: GLNQCTGGLIXRRJ-UHFFFAOYSA-NInChI: InChI=1S/C11H9NO3/c1-7-9(11(13)14)10(15-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,14)
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4-Bromo-3-chloro-2-fluoropyridine
Cas Number: 1017793-21-3Formula: C5H2BrClFNMolecular weight: 210.4Synonyms: 4-Bromo-3-chloro-2-fluoropyridine|1017793-21-3|4-Bromo-3-chloro-2-fluoro-pyridine|Pyridine, 4-bromo-...SMILES: C1=CN=C(C(=C1Br)Cl)FInChIKey: UMQBGWKWOLRROL-UHFFFAOYSA-NInChI: InChI=1S/C5H2BrClFN/c6-3-1-2-9-5(8)4(3)7/h1-2H
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3-iodo-2-methoxypyridin-4-amine
Cas Number: 1190198-21-0Formula: C6H7IN2OMolecular weight: 250.039Synonyms: 3-Iodo-2-methoxypyridin-4-amine|1190198-21-0|3-iodo-2-methoxy-4-pyridinamine|4-Pyridinamine, 3-iodo-...SMILES: COC1=NC=CC(=C1I)NInChIKey: ZTZOSAQQMYQVRA-UHFFFAOYSA-NInChI: InChI=1S/C6H7IN2O/c1-10-6-5(7)4(8)2-3-9-6/h2-3H,1H3,(H2,8,9)
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4-Hexen-3-one, predominantly trans
Formula: C6H10OMolecular weight: 98.14Synonyms: 4-HEXEN-3-ONE|2497-21-4|(E)-hex-4-en-3-one|2-Hexen-4-one|50396-87-7|2-Hexene-4-one|(E)-4-hexen-3-one...SMILES: CCC(=O)C=CCInChIKey: FEWIGMWODIRUJM-HWKANZROSA-NInChI: InChI=1S/C6H10O/c1-3-5-6(7)4-2/h3,5H,4H2,1-2H3/b5-3+
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4-Benzyloxy-3-methoxybenzaldehyde
Cas Number: 2426-87-1Formula: C15H14O3Molecular weight: 242.27Synonyms: W-206883 | STK187550 | NSC22599 | NSC-22599 | 4-(Benzyloxy)-3-methoxybenzaldehyde | 4-(Benzyloxy)-3-...SMILES: COC1=C(C=CC(=C1)C=O)OCC2=CC=CC=C2InChIKey: JSHLOPGSDZTEGQ-UHFFFAOYSA-NInChI: InChI=1S/C15H14O3/c1-17-15-9-13(10-16)7-8-14(15)18-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3
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4-amino-6-methyl-2,3-dihydropyridazin-3-one
Cas Number: 13925-21-8Formula: C5H7N3OMolecular weight: 125.131Synonyms: 13925-21-8|4-Amino-6-methyl-2H-pyridazin-3-one|4-amino-6-methyl-2,3-dihydropyridazin-3-one|4-amino-6...SMILES: CC1=NNC(=O)C(=C1)NInChIKey: CHXJEGAWOLOLIO-UHFFFAOYSA-NInChI: InChI=1S/C5H7N3O/c1-3-2-4(6)5(9)8-7-3/h2H,1H3,(H2,6,7)(H,8,9)
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4-[(3-Methylphenyl)amino]-3-pyridinesulfonamide
Cas Number: 72811-73-5Formula: C12H13N3O2SMolecular weight: 263.32Synonyms: FT-0641424 | 4-(3-Methylphenyl)amino-3-Pyridine Sulfonamide | 4-(m-Tolylamino)pyridine-3-sulfonamide...SMILES: CC1=CC(=CC=C1)NC2=C(C=NC=C2)S(=O)(=O)NInChIKey: ZXPCUGWAKUIOOF-UHFFFAOYSA-NInChI: InChI=1S/C12H13N3O2S/c1-9-3-2-4-10(7-9)15-11-5-6-14-8-12(11)18(13,16)17/h2-8H,1H3,(H,14,15)(H2,13,16,17)
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4-Bromo-3-methylbenzonitrile
Cas Number: 41963-20-6Formula: BrC6H3(CH3)CNMolecular weight: 196.04Synonyms: Z104510740 | 4-bromo-3-methylbenzenecarbonitrile | AB01529 | 4-Bromo-3-methylbenzonitrile | 4-Bromo-...SMILES: CC1=C(C=CC(=C1)C#N)BrInChIKey: SKXUZFJOLNNWIG-UHFFFAOYSA-NInChI: InChI=1S/C8H6BrN/c1-6-4-7(5-10)2-3-8(6)9/h2-4H,1H3
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3-Ethyl-4-methyl-3-pyrroline-2-one
Cas Number: 766-36-9Formula: C7H11NOMolecular weight: 125.17Synonyms: SY032675 | YCTNTSVMJWIYTQ-UHFFFAOYSA-N | 3-Ethyl-4-methyl-2-oxopyrroline | FT-0667991 | 2H-Pyrrol-2-...SMILES: CCC1=C(CNC1=O)CInChIKey: YCTNTSVMJWIYTQ-UHFFFAOYSA-NInChI: InChI=1S/C7H11NO/c1-3-6-5(2)4-8-7(6)9/h3-4H2,1-2H3,(H,8,9)
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4-Hydroxy-3-nitrobenzaldehyde
Cas Number: 3011-34-5Formula: C7H5NO4Molecular weight: 167.12Synonyms: Z57313904 | A820204 | STK397481 | AKOS000120628 | DTXSID80184195 | H0924 | 4-formyl-2-nitro-phenolat...SMILES: C1=CC(=C(C=C1C=O)[N+](=O)[O-])OInChIKey: YTHJCZRFJGXPTL-UHFFFAOYSA-NInChI: InChI=1S/C7H5NO4/c9-4-5-1-2-7(10)6(3-5)8(11)12/h1-4,10H
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4-Chloro-3-fluorophenol
Cas Number: 348-60-7Formula: ClC6(H3(F)OHMolecular weight: 146.55Synonyms: FT-0618067 | 4-Chloro-3-fluorophenol, 98% | SY021811 | 3-Fluoro-4-chlorophenol | 3-fluoro-4-chloro-p...SMILES: C1=CC(=C(C=C1O)F)ClInChIKey: XLHYAEBESNFTCA-UHFFFAOYSA-NInChI: InChI=1S/C6H4ClFO/c7-5-2-1-4(9)3-6(5)8/h1-3,9H
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4-Fluoro-3-nitrobenzyl alcohol
Cas Number: 20274-69-5Formula: FC6H3(NO2)CH2OHMolecular weight: 171.13Synonyms: 4-Fluoro-3-nitrobenzyl alcohol, 96% | (4-fluoro-3-nitrophenyl)methanol | (4-Fluoro-3-nitro-phenyl)-m...SMILES: C1=CC(=C(C=C1CO)[N+](=O)[O-])FInChIKey: MKWJZTFMDWSRIH-UHFFFAOYSA-NInChI: InChI=1S/C7H6FNO3/c8-6-2-1-5(4-10)3-7(6)9(11)12/h1-3,10H,4H2
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3-Chloro-4-fluoroaniline
Formula: C6H5ClFNMolecular weight: 145.56Synonyms: F2190-0461 | SCHEMBL9602 | Z104477780 | 4-fluoro-3-chlorophenylamine | Aniline, 3-chloro-4-fluoro- |...SMILES: C1=CC(=C(C=C1N)Cl)FInChIKey: YSEMCVGMNUUNRK-UHFFFAOYSA-NInChI: InChI=1S/C6H5ClFN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2
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