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Search results for: '54639-48-4'
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Pigment Red 48:4
Cas Number: 5280-66-0Formula: C18H13ClN2O6SMolecular weight: 420.82Synonyms: 4-((5-chloro-4-methyl-2-sulfophenyl)azo)-3-hydroxy-2-naphthalene-carboxylic acid | SCHEMBL2835094 | ...SMILES: CC1=CC(=C(C=C1Cl)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)O)O)S(=O)(=O)OInChIKey: LZNMMJSXOXXHFD-UHFFFAOYSA-NInChI: InChI=1S/C18H13ClN2O6S/c1-9-6-15(28(25,26)27)14(8-13(9)19)20-21-16-11-5-3-2-4-10(11)7-12(17(16)22)18(23)24/h2-8,22H,1H3,(H,23,24)(H,25,26,27)
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7-Phenyl acetamido-3-hydroxy-3-cephem-4-carboxylic acid diphenylmethyl ester
Cas Number: 54639-48-4Formula: C28H24N2O5SMolecular weight: 500.58Synonyms: Diphenylmethyl (6R,7R)-3-hydroxy-8-oxo-7-(2-phenylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-c...SMILES: C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)OInChIKey: HJINVAQLVZRFTL-YIXXDRMTSA-NInChI: InChI=1S/C28H24N2O5S/c31-21-17-36-27-23(29-22(32)16-18-10-4-1-5-11-18)26(33)30(27)24(21)28(34)35-25(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,23,25,27,31H,16-17H2,(H,29,32)/t23-,27-/m1/s1
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4-bromo-2-(methylamino)benzamide
Cas Number: 1369866-48-7Formula: C8H9N2OBrMolecular weight: 229.07Synonyms: 4-bromo-2-(methylamino)benzamide | 1369866-48-7 | MFCD29094359 | PB40440 | D96607SMILES: CNC1=C(C=CC(=C1)Br)C(=O)NInChIKey: MXSBPDKQTBUKDF-UHFFFAOYSA-NInChI: InChI=1S/C8H9BrN2O/c1-11-7-4-5(9)2-3-6(7)8(10)12/h2-4,11H,1H3,(H2,10,12)
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1-Bromo-4-chloroisoquinoline
Cas Number: 925890-48-8Formula: C9H5BrClNMolecular weight: 242.5Synonyms: 1-Bromo-4-chloroisoquinoline|925890-48-8|SCHEMBL17026767|DTXSID50590582|MFCD08437045|AKOS022173803|D...SMILES: C1=CC=C2C(=C1)C(=CN=C2Br)ClInChIKey: DWURDEVVUPUUPU-UHFFFAOYSA-NInChI: InChI=1S/C9H5BrClN/c10-9-7-4-2-1-3-6(7)8(11)5-12-9/h1-5H
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4-(methylamino)pentan-2-ol
Cas Number: 42142-48-3Formula: C6H15NOMolecular weight: 117.19Synonyms: 4-(methylamino)pentan-2-ol | 42142-48-3 | N-methyl-4-amino-2-pentanol | SCHEMBL1291690 | AKOS0063529...SMILES: CC(CC(C)O)NCInChIKey: GJXMSASDQMEPIH-UHFFFAOYSA-NInChI: InChI=1S/C6H15NO/c1-5(7-3)4-6(2)8/h5-8H,4H2,1-3H3
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Camptothecin-20(S)-O-propionate, DNA topoisomerase I inhibitor
Cas Number: 194414-69-2Formula: C23H20N2O5Molecular weight: 404.42Synonyms: CZ48 | CZ-48 | UNII-4S145C552U | 4S145C552U | CZ 48 | SF 6A | 1H-PYRANO(3',4':6,7)INDOLIZINO(1,2-B)Q...SMILES: CCC(=O)OC1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)CCInChIKey: YCNIQYLWIPCLNY-QHCPKHFHSA-NInChI: InChI=1S/C23H20N2O5/c1-3-19(26)30-23(4-2)16-10-18-20-14(9-13-7-5-6-8-17(13)24-20)11-25(18)21(27)15(16)12-29-22(23)28/h5-10H,3-4,11-12H2,1-2H3/t23-/m0/s1
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6-bromo-1,7-dimethyl-indazole
Cas Number: 1337880-48-4Formula: C9H9N2BrMolecular weight: 225.08Synonyms: 6-bromo-1,7-dimethyl-indazole | 1337880-48-4 | 6-BROMO-1,7-DIMETHYL-1H-INDAZOLE | SCHEMBL18070740 | ...SMILES: CC1=C(C=CC2=C1N(N=C2)C)BrInChIKey: YPCXJBIDXAEDHL-UHFFFAOYSA-NInChI: InChI=1S/C9H9BrN2/c1-6-8(10)4-3-7-5-11-12(2)9(6)7/h3-5H,1-2H3
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Diethylphosphonobutanoic acid
Cas Number: 38694-48-3Formula: C8H17O5PMolecular weight: 224.2Synonyms: 38694-48-3|4-(Diethoxyphosphoryl)butanoic acid|4-diethoxyphosphorylbutanoic acid|DIETHYLPHOSPHONOBUT...SMILES: CCOP(=O)(CCCC(=O)O)OCCInChIKey: LCHMQUIASGRBNV-UHFFFAOYSA-NInChI: InChI=1S/C8H17O5P/c1-3-12-14(11,13-4-2)7-5-6-8(9)10/h3-7H2,1-2H3,(H,9,10)
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GDC-0152, Antagonist of baculoviral IAP repeat containing 2;Antagonist of baculoviral IAP repeat containing 3;Antagonist of baculoviral IAP repeat containing 7;Antagonist of X-linked inhibitor of apoptosis
Cas Number: 873652-48-3Formula: C25H34N6O3SMolecular weight: 498.64Synonyms: GDC-0152|873652-48-3|GDC-0152 free base|UNII-4KW1M48SHS|GDC 0152|4KW1M48SHS|(s)-1-((s)-2-cyclohexyl-...SMILES: CC(C(=O)NC(C1CCCCC1)C(=O)N2CCCC2C(=O)NC3=C(N=NS3)C4=CC=CC=C4)NCInChIKey: WZRFLSDVFPIXOV-LRQRDZAKSA-NInChI: See more
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4-Methyl-2-(2-nitrophenyl)oxazole
Cas Number: 951884-48-3Formula: C10H8N2O3Molecular weight: 204.2Synonyms: 4-Methyl-2-(2-nitrophenyl)oxazole|951884-48-3|4-Methyl-2-(2-nitrophenyl)-1,3-oxazole|DTXSID10650030|...SMILES: CC1=COC(=N1)C2=CC=CC=C2[N+](=O)[O-]InChIKey: XKVKKDJHKSYZSZ-UHFFFAOYSA-NInChI: InChI=1S/C10H8N2O3/c1-7-6-15-10(11-7)8-4-2-3-5-9(8)12(13)14/h2-6H,1H3
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4-hydroxy-7-iodo-indan-1-one
Cas Number: 1260017-48-8Formula: C9H7O2IMolecular weight: 274.05Synonyms: SCHEMBL16555466 | 4-HYDROXY-7-IODO-INDAN-1-ONE | F86229 | 4-hydroxy-7-iodo-2,3-dihydro-1H-inden-1-on...SMILES: C1CC(=O)C2=C(C=CC(=C21)O)IInChIKey: FNEKRCOAAVJUAV-UHFFFAOYSA-NInChI: InChI=1S/C9H7IO2/c10-6-2-4-7(11)5-1-3-8(12)9(5)6/h2,4,11H,1,3H2
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9-benzyl-1,4-dioxa-9-azadispiro[4.2.48.25]tetradecane hydroiodide
Cas Number: 1630906-38-5Formula: C18H26INO2Molecular weight: 415.315SMILES: C1CC2(CCC3(CC2)OCCO3)N(C1)CC4=CC=CC=C4.IInChIKey: VFSCHGGYQVTCRU-UHFFFAOYSA-NInChI: InChI=1S/C18H25NO2.HI/c1-2-5-16(6-3-1)15-19-12-4-7-17(19)8-10-18(11-9-17)20-13-14-21-18;/h1-3,5-6H,4,7-15H2;1H
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(4-Chloro-phenyl)-oxo-acetonitrile
Cas Number: 13014-48-7Formula: C8H4ClNOMolecular weight: 165.6Synonyms: 4-chlorobenzoyl cyanide|13014-48-7|(4-CHLORO-PHENYL)-OXO-ACETONITRILE|4-chlorobenzoylcyanide|2-(4-ch...SMILES: C1=CC(=CC=C1C(=O)C#N)ClInChIKey: UDBBCXDMJVNFLI-UHFFFAOYSA-NInChI: InChI=1S/C8H4ClNO/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4H
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3-(4-Methoxyphenyl)propionitrile
Cas Number: 22442-48-4Formula: C10H11NOMolecular weight: 161.21Synonyms: 3-(4-Methoxyphenyl)propionitrile|22442-48-4|3-(4-Methoxyphenyl)propanenitrile|3-(p-Methoxyphenyl)pro...SMILES: COC1=CC=C(C=C1)CCC#NInChIKey: ORAXBZFDDWPRRD-UHFFFAOYSA-NInChI: InChI=1S/C10H11NO/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7H,2-3H2,1H3
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(4-Chlorophenyl)(4-fluorophenyl)methanone
Cas Number: 2069-48-9Formula: C13H8ClFOMolecular weight: 234.7Synonyms: (4-chlorophenyl)(4-fluorophenyl)methanone|2069-48-9|4-CHLORO-4'-FLUOROBENZOPHENONE|(4-chlorophenyl)-...SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)FInChIKey: YGROSAOZMCLHSW-UHFFFAOYSA-NInChI: InChI=1S/C13H8ClFO/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H
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2-(4-chlorophenyl)thioacetamide
Cas Number: 17518-48-8Formula: C8H8ClNSMolecular weight: 185.7Synonyms: 2-(4-chlorophenyl)ethanethioamide|17518-48-8|2-(4-chlorophenyl)thioacetamide|2-(4-Chlorophenyl)-thio...SMILES: C1=CC(=CC=C1CC(=S)N)ClInChIKey: QHCDYIRWTPEABF-UHFFFAOYSA-NInChI: InChI=1S/C8H8ClNS/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H2,10,11)
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7-fluoro-4-methoxy-2-methyl-1H-indole
Cas Number: 1427366-48-0Formula: C10H10FNOMolecular weight: 179.19Synonyms: 7-Fluoro-4-methoxy-2-methyl-1H-indole | 1427366-48-0 | SCHEMBL22407908 | CHC36648 | MFCD23706386 | A...SMILES: CC1=CC2=C(C=CC(=C2N1)F)OCInChIKey: IFEFOSKSUIPVLH-UHFFFAOYSA-NInChI: InChI=1S/C10H10FNO/c1-6-5-7-9(13-2)4-3-8(11)10(7)12-6/h3-5,12H,1-2H3
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1-amino-4-methyl-indane-5-carboxylic acid;hydrochloride
Cas Number: 2708280-48-0Synonyms: SCHEMBL4254987 | 1-Amino-4-methyl-indane-5-carboxylic acid HCl | D79412 | 1-AMINO-4-METHYL-2,3-DIHYD...SMILES: CC1=C(C=CC2=C1CCC2N)C(=O)O.ClInChIKey: YUFVJDTXUGVPEC-UHFFFAOYSA-NInChI: InChI=1S/C11H13NO2.ClH/c1-6-7-4-5-10(12)9(7)3-2-8(6)11(13)14;/h2-3,10H,4-5,12H2,1H3,(H,13,14);1H
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4-Methyl-1-naphthaldehyde
Cas Number: 33738-48-6Formula: C12H10OMolecular weight: 170.21Synonyms: 4-Methyl-1-naphthaldehyde|33738-48-6|4-methylnaphthalene-1-carbaldehyde|1-Naphthalenecarboxaldehyde,...SMILES: CC1=CC=C(C2=CC=CC=C12)C=OInChIKey: LANRGTXVAPBSIA-UHFFFAOYSA-NInChI: InChI=1S/C12H10O/c1-9-6-7-10(8-13)12-5-3-2-4-11(9)12/h2-8H,1H3
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4-(Bromomethyl)-2-chloropyridine hydrobromide
Cas Number: 32938-48-0Formula: C6H6Br2ClNMolecular weight: 287.38Synonyms: 4-(Bromomethyl)-2-chloropyridine hydrobromide|32938-48-0|4-(bromomethyl)-2-chloropyridine;hydrobromi...SMILES: C1=CN=C(C=C1CBr)Cl.BrInChIKey: KNSPYHSMERJTMS-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrClN.BrH/c7-4-5-1-2-9-6(8)3-5;/h1-3H,4H2;1H
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4-amino-6-bromo-pyridin-3-ol
Cas Number: 1033203-48-3Formula: C5H5N2OBrMolecular weight: 189.01Synonyms: 1033203-48-3 | DTXSID701310249 | 4-amino-6-bromopyridin-3-ol | SB53619 | SY129405 | AS-77213 | MFCD1...SMILES: C1=C(C(=CN=C1Br)O)NInChIKey: QOYXIMLVHCIKPC-UHFFFAOYSA-NInChI: InChI=1S/C5H5BrN2O/c6-5-1-3(7)4(9)2-8-5/h1-2,9H,(H2,7,8)
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[2-Fluoro-4-(methylsulfonyl)phenyl]hydrazine
Cas Number: 832714-48-4Formula: C7H9FN2O2SMolecular weight: 204.2Synonyms: 832714-48-4|[2-fluoro-4-(methylsulfonyl)phenyl]hydrazine|(2-Fluoro-4-(methylsulfonyl)phenyl)hydrazin...SMILES: CS(=O)(=O)C1=CC(=C(C=C1)NN)FInChIKey: IOOKDEPCDHCNSK-UHFFFAOYSA-NInChI: InChI=1S/C7H9FN2O2S/c1-13(11,12)5-2-3-7(10-9)6(8)4-5/h2-4,10H,9H2,1H3
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4-(Butylaminocarbonyl)phenylboronic acid
Cas Number: 252663-48-2Formula: C11H16BNO3Molecular weight: 221.1Synonyms: 252663-48-2|4-(Butylaminocarbonyl)phenylboronic acid|(4-(Butylcarbamoyl)phenyl)boronic acid|[4-(buty...SMILES: B(C1=CC=C(C=C1)C(=O)NCCCC)(O)OInChIKey: YPXNMPMFCXGXPU-UHFFFAOYSA-NInChI: InChI=1S/C11H16BNO3/c1-2-3-8-13-11(14)9-4-6-10(7-5-9)12(15)16/h4-7,15-16H,2-3,8H2,1H3,(H,13,14)
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1,3-Difluoro-2-methyl-5-nitrobenzene
Cas Number: 170572-48-2Formula: C7H5F2NO2Molecular weight: 173.12Synonyms: 1,3-difluoro-2-methyl-5-nitrobenzene|170572-48-2|2,6-Difluoro-4-nitrotoluene|SCHEMBL8467266|DTXSID40...SMILES: CC1=C(C=C(C=C1F)[N+](=O)[O-])FInChIKey: QRGQSKODTJDDHT-UHFFFAOYSA-NInChI: InChI=1S/C7H5F2NO2/c1-4-6(8)2-5(10(11)12)3-7(4)9/h2-3H,1H3
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