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Search results for: '2791273-88-4'
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3,5-Difluoro-4-formylbenzoic acid
Cas Number: 736990-88-8Formula: C8H4F2O3Molecular weight: 186.1Synonyms: 3,5-difluoro-4-formylbenzoic acid|736990-88-8|4-CARBOXY-2,6-DIFLUOROBENZALDEHYDE|3,5-difluoro-4-form...SMILES: C1=C(C=C(C(=C1F)C=O)F)C(=O)OInChIKey: FRAXEZGWRAVEIK-UHFFFAOYSA-NInChI: InChI=1S/C8H4F2O3/c9-6-1-4(8(12)13)2-7(10)5(6)3-11/h1-3H,(H,12,13)
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2,6-Difluoro-4-formylbenzonitrile
Cas Number: 433939-88-9Formula: C8H3F2NOMolecular weight: 167.1Synonyms: 2,6-Difluoro-4-formylbenzonitrile|433939-88-9|4-cyano-3,5-difluorobenzaldehyde|Benzonitrile, 2,6-dif...SMILES: C1=C(C=C(C(=C1F)C#N)F)C=OInChIKey: TUOLCSUKMUVDOE-UHFFFAOYSA-NInChI: InChI=1S/C8H3F2NO/c9-7-1-5(4-12)2-8(10)6(7)3-11/h1-2,4H
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methyl 4-(4-hydroxybutyl)benzoate
Cas Number: 123910-88-3Formula: C12H16O3Molecular weight: 208.25Synonyms: 123910-88-3|methyl 4-(4-hydroxybutyl)benzoate|4-(4-hydroxybutyl)benzoic acid methyl ester|methyl 4-(...SMILES: COC(=O)C1=CC=C(C=C1)CCCCOInChIKey: KVKWRSNRAXOBFC-UHFFFAOYSA-NInChI: InChI=1S/C12H16O3/c1-15-12(14)11-7-5-10(6-8-11)4-2-3-9-13/h5-8,13H,2-4,9H2,1H3
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4-(4-Methoxy-phenyl)-5-methyl-thiazol-2-ylamine
Cas Number: 105512-88-7Formula: C11H12N2OSMolecular weight: 220.3Synonyms: 105512-88-7|4-(4-Methoxy-phenyl)-5-methyl-thiazol-2-ylamine|4-(4-methoxyphenyl)-5-methyl-1,3-thiazol...SMILES: CC1=C(N=C(S1)N)C2=CC=C(C=C2)OCInChIKey: WUTXFLYFZOMYSF-UHFFFAOYSA-NInChI: InChI=1S/C11H12N2OS/c1-7-10(13-11(12)15-7)8-3-5-9(14-2)6-4-8/h3-6H,1-2H3,(H2,12,13)
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[(1S,2S)-2-(4-chlorophenyl)cyclopropyl]methanol
Cas Number: 388631-88-7Formula: C10H11OClMolecular weight: 182.65Synonyms: 388631-88-7 | [trans-2-(4-chlorophenyl)cyclopropyl]methanol | [(1S,2S)-2-(4-Chlorophenyl)cyclopropyl...SMILES: C1C(C1C2=CC=C(C=C2)Cl)COInChIKey: RHLUDCBNPQCUQK-PSASIEDQSA-NInChI: InChI=1S/C10H11ClO/c11-9-3-1-7(2-4-9)10-5-8(10)6-12/h1-4,8,10,12H,5-6H2/t8-,10-/m1/s1
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(S)-2-isocyanato-4-(methylthio)butyric acid methyl ester
Cas Number: 93778-88-2Formula: C7H11NO3SMolecular weight: 189.23Synonyms: 93778-88-2|Methyl (S)-(-)-2-Isocyanato-4-(methylthio)butyrate|methyl (2S)-2-isocyanato-4-methylsulfa...SMILES: COC(=O)C(CCSC)N=C=OInChIKey: LTRPJRSRZAQDQI-LURJTMIESA-NInChI: InChI=1S/C7H11NO3S/c1-11-7(10)6(8-5-9)3-4-12-2/h6H,3-4H2,1-2H3/t6-/m0/s1
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1-(2,6-Dichloro-4-(trifluoromethyl)phenyl)ethanone
Cas Number: 175205-88-6Formula: C9H5Cl2F3OMolecular weight: 257.04Synonyms: 175205-88-6|1-(2,6-Dichloro-4-(trifluoromethyl)phenyl)ethanone|2',6'-DICHLORO-4'-(TRIFLUOROMETHYL)AC...SMILES: CC(=O)C1=C(C=C(C=C1Cl)C(F)(F)F)ClInChIKey: NREOBJSTBKEWNY-UHFFFAOYSA-NInChI: InChI=1S/C9H5Cl2F3O/c1-4(15)8-6(10)2-5(3-7(8)11)9(12,13)14/h2-3H,1H3
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5‐bromo‐4‐chloro‐2‐methylaniline
Cas Number: 1126367-88-1Formula: C7H7BrClNMolecular weight: 220.494Synonyms: 5-Bromo-4-chloro-2-methylaniline|1126367-88-1|5-Bromo-4-chloro-2-methyl-phenylamine|5-bromo-4-chloro...SMILES: CC1=CC(=C(C=C1N)Br)ClInChIKey: INBHOPYATVVLEM-UHFFFAOYSA-NInChI: InChI=1S/C7H7BrClN/c1-4-2-6(9)5(8)3-7(4)10/h2-3H,10H2,1H3
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5-Chloro-2-formylbenzonitrile
Cas Number: 77532-88-8Formula: C8H4ClNOMolecular weight: 165.58Synonyms: 5-CHLORO-2-FORMYLBENZONITRILE|77532-88-8|4-CHLORO-2-CYANOBENZALDEHYDE|5-Chloro-2-formyl benzonitrile...SMILES: C1=CC(=C(C=C1Cl)C#N)C=OInChIKey: PAYXNEOSNJICEG-UHFFFAOYSA-NInChI: InChI=1S/C8H4ClNO/c9-8-2-1-6(5-11)7(3-8)4-10/h1-3,5H
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4-Chlorophenoxyacetic acid
Cas Number: 122-88-3Formula: C8H7ClO3Molecular weight: 186.59Synonyms: 4-CHLOROPHENOXYACETIC ACID|122-88-3|2-(4-chlorophenoxy)acetic acid|(4-Chlorophenoxy)acetic acid|4-CP...SMILES: C1=CC(=CC=C1OCC(=O)O)ClInChIKey: SODPIMGUZLOIPE-UHFFFAOYSA-NInChI: InChI=1S/C8H7ClO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
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Mavacoxib
Cas Number: 170569-88-7Formula: C16H11F4N3O2SMolecular weight: 385.34Synonyms: Mavacoxib|170569-88-7|Trocoxil|PHA-739521|PHA 739,521|YFT7X7SR77|4-[5-(4-fluorophenyl)-3-(trifluorom...SMILES: C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)FInChIKey: TTZNQDOUNXBMJV-UHFFFAOYSA-NInChI: InChI=1S/C16H11F4N3O2S/c17-11-3-1-10(2-4-11)14-9-15(16(18,19)20)22-23(14)12-5-7-13(8-6-12)26(21,24)25/h1-9H,(H2,21,24,25)
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4-(1H-Tetrazol-5-yl)phenol
Cas Number: 51517-88-5Formula: C7H6N4OMolecular weight: 162.15Synonyms: 4-(1H-TETRAZOL-5-YL)PHENOL|51517-88-5|5-(4-Hydroxyphenyl)tetrazole|4-(2h-tetrazol-5-yl)phenol|MFCD05...SMILES: C1=CC(=CC=C1C2=NNN=N2)OInChIKey: QOYMNYWFHZFXHR-UHFFFAOYSA-NInChI: InChI=1S/C7H6N4O/c12-6-3-1-5(2-4-6)7-8-10-11-9-7/h1-4,12H,(H,8,9,10,11)
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4-Propoxy-3-methylphenylboronic acid
Cas Number: 279262-88-3Formula: C10H15BO3Molecular weight: 194Synonyms: 279262-88-3|(3-methyl-4-propoxyphenyl)boronic acid|3-methyl-4-propoxyphenylboronic acid|4-Propoxy-3-...SMILES: B(C1=CC(=C(C=C1)OCCC)C)(O)OInChIKey: DXQZYSHXBAHHAG-UHFFFAOYSA-NInChI: InChI=1S/C10H15BO3/c1-3-6-14-10-5-4-9(11(12)13)7-8(10)2/h4-5,7,12-13H,3,6H2,1-2H3
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ethanone, 1-[3-(acetyloxy)-4-methoxyphenyl]-
Cas Number: 60792-88-3Formula: C11H12O4Molecular weight: 208.213Synonyms: 5-Acetyl-2-methoxyphenyl acetate|60792-88-3|(5-acetyl-2-methoxyphenyl) acetate|Ethanone, 1-[3-(acety...SMILES: CC(=O)C1=CC(=C(C=C1)OC)OC(=O)CInChIKey: TWPFICFACFZUQL-UHFFFAOYSA-NInChI: InChI=1S/C11H12O4/c1-7(12)9-4-5-10(14-3)11(6-9)15-8(2)13/h4-6H,1-3H3
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(4-Chlorophenylthio)acetic acid
Cas Number: 3405-88-7Formula: C8H7ClO2SMolecular weight: 202.66Synonyms: 3405-88-7|(4-Chlorophenylthio)acetic acid|2-((4-Chlorophenyl)thio)acetic acid|[(4-chlorophenyl)thio]...SMILES: C1=CC(=CC=C1SCC(=O)O)ClInChIKey: YPKLXLYGMAWXDO-UHFFFAOYSA-NInChI: InChI=1S/C8H7ClO2S/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
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1-Cyclopropyl-1-phenylmethanamine
Cas Number: 23459-38-3Formula: C10H13NMolecular weight: 147.2Synonyms: cyclopropyl(phenyl)methanamine|23459-38-3|1-cyclopropyl-1-phenylmethanamine|C10H13N|MFCD05191945|alp...SMILES: C1CC1C(C2=CC=CC=C2)NInChIKey: UCRSQPUGEDLYSH-UHFFFAOYSA-NInChI: InChI=1S/C10H13N/c11-10(9-6-7-9)8-4-2-1-3-5-8/h1-5,9-10H,6-7,11H2
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2,3-Difluoro-4-(heptyloxy)phenylboronic acid
Cas Number: 147222-88-6Formula: C13H19BF2O3Molecular weight: 272.1Synonyms: 147222-88-6|(2,3-Difluoro-4-(heptyloxy)phenyl)boronic acid|2,3-difluoro-4-(heptyloxy)phenylboronic a...SMILES: B(C1=C(C(=C(C=C1)OCCCCCCC)F)F)(O)OInChIKey: YRNVGZHHONVNLO-UHFFFAOYSA-NInChI: InChI=1S/C13H19BF2O3/c1-2-3-4-5-6-9-19-11-8-7-10(14(17)18)12(15)13(11)16/h7-8,17-18H,2-6,9H2,1H3
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[trans-2-(4-chlorophenyl)cyclopropyl]methanol
Cas Number: 258355-37-2Formula: C10H11OClMolecular weight: 182.65Synonyms: 388631-88-7 | [trans-2-(4-chlorophenyl)cyclopropyl]methanol | [(1S,2S)-2-(4-Chlorophenyl)cyclopropyl...SMILES: C1C(C1C2=CC=C(C=C2)Cl)COInChIKey: RHLUDCBNPQCUQK-PSASIEDQSA-NInChI: InChI=1S/C10H11ClO/c11-9-3-1-7(2-4-9)10-5-8(10)6-12/h1-4,8,10,12H,5-6H2/t8-,10-/m1/s1
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LAU463, Allosteric modulator of GABA A receptor α6 subunit
Synonyms: 7-Bromo-2,5-dihydro-2-(4-methoxyphenyl)-3H-pyrazolo[4,3-c]quinolin-3-one | compound 8n [PMID: 294817...SMILES: COC1=CC=C(C=C1)N2N=C3C(=CNC4=C3C=CC(Br)=C4)C2=OInChIKey: CAJJWNTVLDPILI-UHFFFAOYSA-NInChI: InChI=1S/C17H12BrN3O2/c1-23-12-5-3-11(4-6-12)21-17(22)14-9-19-15-8-10(18)2-7-13(15)16(14)20-21/h2-9,19H,1H3
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4-Isopropylaniline
Formula: C9H13NMolecular weight: 135.21Synonyms: 4-ISOPROPYLANILINE|99-88-7|Cumidine|4-Aminocumene|p-Isopropylaniline|p-Cumidine|4-Amino-1-isopropylb...SMILES: CC(C)C1=CC=C(C=C1)NInChIKey: LRTFPLFDLJYEKT-UHFFFAOYSA-NInChI: InChI=1S/C9H13N/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,10H2,1-2H3
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methyl 6-amino-4-bromopyridine-2-carboxylate
Cas Number: 885326-88-5Formula: C7H7BrN2O2Molecular weight: 231.05Synonyms: methyl 6-amino-4-bromopicolinate | 885326-88-5 | 2-AMINO-4-BROMO-6-CARBOXYPYRIDINE METHYL ESTER | me...SMILES: COC(=O)C1=NC(=CC(=C1)Br)NInChIKey: IVNUJUSMGMFTJA-UHFFFAOYSA-NInChI: InChI=1S/C7H7BrN2O2/c1-12-7(11)5-2-4(8)3-6(9)10-5/h2-3H,1H3,(H2,9,10)
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BMS-986122, Allosteric modulator of μ receptor
Cas Number: 313669-88-4Formula: C16H15BrClNO3S2Molecular weight: 448.78Synonyms: BMS-986122|313669-88-4|2-(3-bromo-4-methoxyphenyl)-3-(4-chlorophenyl)sulfonyl-1,3-thiazolidine|2-(3-...SMILES: COC1=C(C=C(C=C1)C2N(CCS2)S(=O)(=O)C3=CC=C(C=C3)Cl)BrInChIKey: PNGJPVDGZNPZHY-UHFFFAOYSA-NInChI: InChI=1S/C16H15BrClNO3S2/c1-22-15-7-2-11(10-14(15)17)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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MCOPPB trihydrochloride
Cas Number: 1108147-88-1Formula: C₂₆H₄₀N₄.₃HClMolecular weight: 534.05Synonyms: MCOPPB triHydrochloride | 1-[1-(1-Methylcyclooctyl)piperidin-4-yl]-2-[(3R)-piperidin-3-yl]benzimidaz...SMILES: CC1(CCCCCCC1)N2CCC(CC2)N3C4=CC=CC=C4N=C3C5CCCNC5.Cl.Cl.ClInChIKey: DTIPEVOPCGEULQ-RFCADEKQSA-NInChI: InChI=1S/C26H40N4.3ClH/c1-26(15-7-3-2-4-8-16-26)29-18-13-22(14-19-29)30-24-12-6-5-11-23(24)28-25(30)21-10-9-17-27-20-21;;;/h5-6,11-12,21-22,27H,2-4,7-10,13-20H2,1H3;3*1H/t21-;;;/m1.../s1
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N-Carbobenzoxy-l-homoserine
Cas Number: 35677-88-4Formula: C12H15NO5Molecular weight: 253.3Synonyms: Cbz-L-Homoserine|35677-88-4|N-carbobenzoxy-l-homoserine|(2S)-4-hydroxy-2-(phenylmethoxycarbonylamino...SMILES: C1=CC=C(C=C1)COC(=O)NC(CCO)C(=O)OInChIKey: UBXPAGGJJMSWLC-JTQLQIEISA-NInChI: InChI=1S/C12H15NO5/c14-7-6-10(11(15)16)13-12(17)18-8-9-4-2-1-3-5-9/h1-5,10,14H,6-8H2,(H,13,17)(H,15,16)/t10-/m0/s1
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