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Search results for: '54897-59-5'
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Valganciclovir HCl, Human herpesvirus 1 DNA polymerase inhibitor
Cas Number: 175865-59-5Formula: C14H22N6O5·HClMolecular weight: 390.82Synonyms: Valganciclovir hydrochloride|175865-59-5|Valganciclovir HCl|Valcyte|Valcyt|Valganciclovir (hydrochlo...SMILES: CC(C)C(C(=O)OCC(CO)OCN1C=NC2=C1N=C(NC2=O)N)N.ClInChIKey: ZORWARFPXPVJLW-MTFPJWTKSA-NInChI: InChI=1S/C14H22N6O5.ClH/c1-7(2)9(15)13(23)24-4-8(3-21)25-6-20-5-17-10-11(20)18-14(16)19-12(10)22;/h5,7-9,21H,3-4,6,15H2,1-2H3,(H3,16,18,19,22);1H/t8?,9-;/m0./s1
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rel-tert-butyl (1S,4S,5R)-5-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
Synonyms: tert-butyl (1S,4S,5R)-5-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate|1932042-59-5|198835-03-9|re...SMILES: CC(C)(C)OC(=O)N1CC2CC1CC2OInChIKey: HDPGSWMTDGGUEB-XHNCKOQMSA-NInChI: InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)12-6-7-4-8(12)5-9(7)13/h7-9,13H,4-6H2,1-3H3/t7-,8-,9+/m0/s1
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BMS-687453
Cas Number: 1000998-59-3Formula: C22H21ClN2O6Molecular weight: 444.86Synonyms: BMS-687453|1000998-59-3|Glycine, N-[[3-[[2-(4-chlorophenyl)-5-methyl-4-oxazolyl]methoxy]phenyl]methy...SMILES: CC1=C(N=C(O1)C2=CC=C(C=C2)Cl)COC3=CC=CC(=C3)CN(CC(=O)O)C(=O)OCInChIKey: UJIBXDMNCMEJAY-UHFFFAOYSA-NInChI: InChI=1S/C22H21ClN2O6/c1-14-19(24-21(31-14)16-6-8-17(23)9-7-16)13-30-18-5-3-4-15(10-18)11-25(12-20(26)27)22(28)29-2/h3-10H,11-13H2,1-2H3,(H,26,27)
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3-(Piperidin-1-ylmethyl)phenylboronic acid
Cas Number: 1032610-59-5Formula: C12H18BNO2Molecular weight: 219.1Synonyms: 3-(Piperidin-1-ylmethyl)phenylboronic acid|1032610-59-5|(3-(Piperidin-1-ylmethyl)phenyl)boronic acid...SMILES: B(C1=CC(=CC=C1)CN2CCCCC2)(O)OInChIKey: XXOOQRVPTGXIAP-UHFFFAOYSA-NInChI: InChI=1S/C12H18BNO2/c15-13(16)12-6-4-5-11(9-12)10-14-7-2-1-3-8-14/h4-6,9,15-16H,1-3,7-8,10H2
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S-Carboxymethyl-L-cysteine
Cas Number: 2387-59-9Formula: C5H9NO4SMolecular weight: 179.19Synonyms: 25390-17-4|S-(Carboxymethyl)-DL-cysteine|S-Carboxymethylcysteine|2387-59-9|(RS)-Carbocisteine|S-(Car...SMILES: C(C(C(=O)O)N)SCC(=O)OInChIKey: GBFLZEXEOZUWRN-UHFFFAOYSA-NInChI: InChI=1S/C5H9NO4S/c6-3(5(9)10)1-11-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)
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Oteseconazole, Lanosterol 14-alpha demethylase inhibitor
Cas Number: 1340593-59-0 EC Number: 841-499-2Formula: C23H16F7N5O2Molecular weight: 527.39Synonyms: CHEBI:188153 | Oteseconazole | 1340593-59-0 | 2-Pyridineethanol, alpha-(2,4-difluorophenyl)-beta,bet...SMILES: C1=CC(=CC=C1C2=CN=C(C=C2)C(C(CN3C=NN=N3)(C4=C(C=C(C=C4)F)F)O)(F)F)OCC(F)(F)FInChIKey: IDUYJRXRDSPPRC-NRFANRHFSA-NInChI: InChI=1S/C23H16F7N5O2/c24-16-4-7-18(19(25)9-16)21(36,11-35-13-32-33-34-35)23(29,30)20-8-3-15(10-31-20)14-1-5-17(6-2-14)37-12-22(26,27)28/h1-10,13,36H,11-12H2/t21-/m0/s1
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R 59-022 hydrochloride
Cas Number: 93076-98-3Formula: C27H27ClFN3OSMolecular weight: 496.04SMILES: O=C1C(CCN(CC/2)CCC2=C(C3=CC=CC=C3)/C4=CC=C(F)C=C4)=C(C)N=C5N1C=CS5.[H]Cl
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Candesartan-d5
Cas Number: 1189650-58-5Formula: C24H15D5N6O3Molecular weight: 445.48Synonyms: 2-[(~2~H_5_)Ethyloxy]-1-{[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl}-1H-benzimidazole-7-carbo...SMILES: CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)OInChIKey: HTQMVQVXFRQIKW-ZBJDZAJPSA-NInChI: InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)/i1D3,2D2
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2-Acetylamino-4-(chloromethyl)thiazole
Cas Number: 7460-59-5Formula: C6H7ClN2OSMolecular weight: 190.7Synonyms: 7460-59-5|2-Acetylamino-4-(chloromethyl)thiazole|N-[4-(Chloromethyl)-1,3-thiazol-2-yl]acetamide|2-Ac...SMILES: CC(=O)NC1=NC(=CS1)CClInChIKey: NBUKMHXINQOFDI-UHFFFAOYSA-NInChI: InChI=1S/C6H7ClN2OS/c1-4(10)8-6-9-5(2-7)3-11-6/h3H,2H2,1H3,(H,8,9,10)
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4,4,5,5-tetramethyl-2-[(Z)-prop-1-enyl]-1,3,2-dioxaborolane
Cas Number: 83947-59-5Formula: C9H17BO2Molecular weight: 168.04Synonyms: 83947-59-5 | (Z)-4,4,5,5-Tetramethyl-2-(prop-1-en-1-yl)-1,3,2-dioxaborolane | cis-1-Propenylboronic ...SMILES: B1(OC(C(O1)(C)C)(C)C)C=CCInChIKey: COPMASWDWLENMV-SREVYHEPSA-NInChI: InChI=1S/C9H17BO2/c1-6-7-10-11-8(2,3)9(4,5)12-10/h6-7H,1-5H3/b7-6-
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1-(2-Amino-5-chlorophenyl)-2,2,2-trifluoroethanone hydrochloride hydrate
Cas Number: 1184936-21-7Formula: C8H8Cl2F3NO2Molecular weight: 278.06Synonyms: 4-Chloro-2-(trifluoroacetyl)aniline hydrochloride hydrate|1184936-21-7|173676-59-0|1-(2-Amino-5-chlo...SMILES: C1=CC(=C(C=C1Cl)C(=O)C(F)(F)F)N.O.ClInChIKey: FUYMYLYDBVWEHG-UHFFFAOYSA-NInChI: InChI=1S/C8H5ClF3NO.ClH.H2O/c9-4-1-2-6(13)5(3-4)7(14)8(10,11)12;;/h1-3H,13H2;1H;1H2
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Glyoxylic acid monohydrate
Formula: C2H2O3.H2OMolecular weight: 92.05Synonyms: Glyoxylic acid monohydrate|2-oxoacetic acid hydrate|563-96-2|Glyoxylic Acid Hydrate|1152495-30-1|oxa...SMILES: C(=O)C(=O)O.OInChIKey: MOOYVEVEDVVKGD-UHFFFAOYSA-NInChI: InChI=1S/C2H2O3.H2O/c3-1-2(4)5;/h1H,(H,4,5);1H2
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2-Fluoro-4-(3-trifluoromethylphenyl)benzoic acid
Cas Number: 926222-59-5Formula: C14H8F4O2Molecular weight: 284.2Synonyms: 926222-59-5|3-Fluoro-3'-(trifluoromethyl)-[1,1'-biphenyl]-4-carboxylic acid|2-FLUORO-4-(3-TRIFLUOROM...SMILES: C1=CC(=CC(=C1)C(F)(F)F)C2=CC(=C(C=C2)C(=O)O)FInChIKey: FOMRSNDIYBAOSO-UHFFFAOYSA-NInChI: InChI=1S/C14H8F4O2/c15-12-7-9(4-5-11(12)13(19)20)8-2-1-3-10(6-8)14(16,17)18/h1-7H,(H,19,20)
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Rivaroxaban-d4
Cas Number: 1132681-38-9Formula: C19H14D4ClN3O5SMolecular weight: 439.91Synonyms: AKOS040736674 | 1132681-38-9 | BAY 59-7939-d4 | DTXSID60649494 | 5-Chloro-N-({(5S)-2-oxo-3-[4-(3-oxo...SMILES: C1COCC(=O)N1C2=CC=C(C=C2)N3CC(OC3=O)CNC(=O)C4=CC=C(S4)ClInChIKey: KGFYHTZWPPHNLQ-UJCPGTITSA-NInChI: InChI=1S/C19H18ClN3O5S/c20-16-6-5-15(29-16)18(25)21-9-14-10-23(19(26)28-14)13-3-1-12(2-4-13)22-7-8-27-11-17(22)24/h1-6,14H,7-11H2,(H,21,25)/t14-/m0/s1/i1D,2D,3D,4D
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2-Chloro-4-(4-fluoro-phenyl)-pyrimidine
Cas Number: 85979-59-5Formula: C10H6ClFN2Molecular weight: 208.62Synonyms: 2-Chloro-4-(4-fluoro-phenyl)-pyrimidine|85979-59-5|2-Chloro-4-(4-fluorophenyl)pyrimidine|SCHEMBL4461...SMILES: C1=CC(=CC=C1C2=NC(=NC=C2)Cl)FInChIKey: DGTAWQNEBOGYLH-UHFFFAOYSA-NInChI: InChI=1S/C10H6ClFN2/c11-10-13-6-5-9(14-10)7-1-3-8(12)4-2-7/h1-6H
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Ethyl 2-methylthiazole-4-carboxylate
Cas Number: 6436-59-5Formula: C7H9NO2SMolecular weight: 171.22Synonyms: Ethyl 2-methylthiazole-4-carboxylate|6436-59-5|ethyl 2-methyl-1,3-thiazole-4-carboxylate|2-Methyl-th...SMILES: CCOC(=O)C1=CSC(=N1)CInChIKey: QWWPUBQHZFHZSF-UHFFFAOYSA-NInChI: InChI=1S/C7H9NO2S/c1-3-10-7(9)6-4-11-5(2)8-6/h4H,3H2,1-2H3
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(-)-Fenchone
Cas Number: 7787-20-4Formula: C10H16OMolecular weight: 152.24Synonyms: UNII-K6G5Y2Y3Q2 | (-)-Fenchone, analytical standard | 2H-Indol-2-one, 7-benzoyl-1,3-dihydro- | Bicyc...SMILES: CC1(C2CCC(C2)(C1=O)C)CInChIKey: LHXDLQBQYFFVNW-OIBJUYFYSA-NInChI: InChI=1S/C10H16O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7H,4-6H2,1-3H3/t7-,10+/m0/s1
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4-Bromo-2-piperazinopyridine
Cas Number: 1201643-59-5Formula: C9H12BrN3Molecular weight: 242.1Synonyms: 1-(4-Bromopyridin-2-yl)piperazine|1201643-59-5|4-Bromo-2-piperazinopyridine|1-(4-Bromo-2-pyridyl)pip...SMILES: C1CN(CCN1)C2=NC=CC(=C2)BrInChIKey: CRQIQJZMQXBIHG-UHFFFAOYSA-NInChI: InChI=1S/C9H12BrN3/c10-8-1-2-12-9(7-8)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2
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Poly(9-vinylcarbazole)
Cas Number: 25067-59-8Synonyms: 9-Vinylcarbazole|1484-13-5|N-Vinylcarbazole|9-Vinyl-9H-carbazole|9H-Carbazole, 9-ethenyl-|25067-59-8...SMILES: C=CN1C2=CC=CC=C2C3=CC=CC=C31InChIKey: KKFHAJHLJHVUDM-UHFFFAOYSA-NInChI: InChI=1S/C14H11N/c1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h2-10H,1H2
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4,6-dihydrofuro[3,4-b]furan-3-carboxylic acid
Cas Number: 164797-59-5Formula: C7H6O4Molecular weight: 154.12Synonyms: 164797-59-5 | 4,6-dihydrofuro[3,4-b]furan-3-carboxylic acid | Furo[3,4-b]furan-3-carboxylic acid, 4,...SMILES: C1C2=C(CO1)OC=C2C(=O)OInChIKey: SARLSCVUZGILKG-UHFFFAOYSA-NInChI: InChI=1S/C7H6O4/c8-7(9)5-2-11-6-3-10-1-4(5)6/h2H,1,3H2,(H,8,9)
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2-(Propylaminomethyl)-5-fluorophenylboronic acid, pinacol ester
Cas Number: 1256360-59-4Formula: C16H25BFNO2Molecular weight: 293.2Synonyms: 1256360-59-4|N-(4-Fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)propan-1-amine|2-(Pro...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C(C=CC(=C2)F)CNCCCInChIKey: YIUAXEAMKCUMFH-UHFFFAOYSA-NInChI: InChI=1S/C16H25BFNO2/c1-6-9-19-11-12-7-8-13(18)10-14(12)17-20-15(2,3)16(4,5)21-17/h7-8,10,19H,6,9,11H2,1-5H3
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scyllo-Inositol
Cas Number: 488-59-5Formula: C6H12O6Molecular weight: 180.16Synonyms: inositol|myo-inositol|Scyllo-inositol|epi-Inositol|Muco-Inositol|Allo-inositol|i-Inositol|87-89-8|me...SMILES: C1(C(C(C(C(C1O)O)O)O)O)OInChIKey: CDAISMWEOUEBRE-UHFFFAOYSA-NInChI: InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H
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Cycloheptane
Formula: C7H14Molecular weight: 98.19Synonyms: EINECS 206-030-2 | Q423957 | NSC 5164 | J-017413 | Suberane | CYCLOHEPTANE | D89252 | AKOS015903170 ...SMILES: C1CCCCCC1InChIKey: DMEGYFMYUHOHGS-UHFFFAOYSA-NInChI: InChI=1S/C7H14/c1-2-4-6-7-5-3-1/h1-7H2
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