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Search results for: '1581754-84-8'
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Buspirone, Agonist of 5-HT 1A receptor;Agonist of 5-HT 7 receptor;Antagonist of 5-HT 7 receptor
Cas Number: 36505-84-7Formula: C21H31N5O2Molecular weight: 385.5Synonyms: BPBio1_001403 | Lopac-B-7148 | NCGC00015162-01 | NCGC00016820-01 | Tox21_110092_1 | A924049 | Buspir...SMILES: C1CCC2(C1)CC(=O)N(C(=O)C2)CCCCN3CCN(CC3)C4=NC=CC=N4InChIKey: QWCRAEMEVRGPNT-UHFFFAOYSA-NInChI: InChI=1S/C21H31N5O2/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20/h5,8-9H,1-4,6-7,10-17H2
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2-(3-Fluorophenyl)thiazole-5-carbaldehyde
Cas Number: 914348-84-8Formula: C10H6FNOSMolecular weight: 207.2Synonyms: 2-(3-Fluorophenyl)thiazole-5-carbaldehyde|914348-84-8|2-(3-fluorophenyl)-1,3-thiazole-5-carbaldehyde...SMILES: C1=CC(=CC(=C1)F)C2=NC=C(S2)C=OInChIKey: DVWKNTOIBIVPPA-UHFFFAOYSA-NInChI: InChI=1S/C10H6FNOS/c11-8-3-1-2-7(4-8)10-12-5-9(6-13)14-10/h1-6H
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5-(2,4-Dimethylphenyl)picolinic acid
Cas Number: 1226037-84-8Formula: C14H13NO2Molecular weight: 227.3Synonyms: 5-(2,4-Dimethylphenyl)picolinic acid|1226037-84-8|5-(2,4-dimethylphenyl)pyridine-2-carboxylic acid|5...SMILES: CC1=CC(=C(C=C1)C2=CN=C(C=C2)C(=O)O)CInChIKey: XMGLKUXHZFHPPO-UHFFFAOYSA-NInChI: InChI=1S/C14H13NO2/c1-9-3-5-12(10(2)7-9)11-4-6-13(14(16)17)15-8-11/h3-8H,1-2H3,(H,16,17)
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Aleuritic Acid
Formula: C16H32O5Molecular weight: 304.42Synonyms: NSC 7668 | Hexadecanoic acid, 9,10,16-trihydroxy-, (theta,S)-(+/-)- | 442LQ2K03A | Hexadecanoic acid...SMILES: C(CCCC(C(CCCCCCO)O)O)CCCC(=O)OInChIKey: MEHUJCGAYMDLEL-CABCVRRESA-NInChI: InChI=1S/C16H32O5/c17-13-9-5-4-7-11-15(19)14(18)10-6-2-1-3-8-12-16(20)21/h14-15,17-19H,1-13H2,(H,20,21)/t14-,15+/m1/s1
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1,5-Dimethylpyrazole-3-carbonyl chloride
Cas Number: 49783-84-8Formula: C6H7ClN2OMolecular weight: 158.59Synonyms: 1,5-Dimethyl-1H-Pyrazole-3-Carbonyl Chloride|49783-84-8|1,5-dimethylpyrazole-3-carbonyl chloride|SCH...SMILES: CC1=CC(=NN1C)C(=O)ClInChIKey: BADBQYAILRGCBB-UHFFFAOYSA-NInChI: InChI=1S/C6H7ClN2O/c1-4-3-5(6(7)10)8-9(4)2/h3H,1-2H3
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Thiophen-3-ylmethanamine hydrochloride
Cas Number: 115132-84-8Formula: C5H8ClNSMolecular weight: 149.64Synonyms: 115132-84-8|thiophen-3-ylmethanamine hydrochloride|Thiophen-3-ylmethyl-ammonium chloride|(thiophen-3...SMILES: C1=CSC=C1CN.ClInChIKey: CUWJIHMNGIOCCE-UHFFFAOYSA-NInChI: InChI=1S/C5H7NS.ClH/c6-3-5-1-2-7-4-5;/h1-2,4H,3,6H2;1H
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3-methylpiperidin-4-ol hydrochloride
Cas Number: 1185293-84-8Formula: C6H14ClNOMolecular weight: 151.63Synonyms: 3-Methylpiperidin-4-ol hydrochloride|1185293-84-8|3-Methyl-piperidin-4-ol hydrochloride|3-methylpipe...SMILES: CC1CNCCC1O.ClInChIKey: RRSULSNKSVBZRD-UHFFFAOYSA-NInChI: InChI=1S/C6H13NO.ClH/c1-5-4-7-3-2-6(5)8;/h5-8H,2-4H2,1H3;1H
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7-bromo-1,3-dimethyl-1H-indazole
Cas Number: 1159511-84-8Formula: C9H9BrN2Molecular weight: 225.089Synonyms: 7-Bromo-1,3-dimethyl-1H-indazole|1159511-84-8|7-bromo-1,3-dimethylindazole|1H-Indazole, 7-bromo-1,3-...SMILES: CC1=NN(C2=C1C=CC=C2Br)CInChIKey: ITJITARZCHQKQK-UHFFFAOYSA-NInChI: InChI=1S/C9H9BrN2/c1-6-7-4-3-5-8(10)9(7)12(2)11-6/h3-5H,1-2H3
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2-Methylanthraquinone
Formula: C15H10O2Molecular weight: 222.24Synonyms: 2-MAQ | D85134 | AE-641/00352041 | 2-METHYLANTHRAQUINONE [MI] | 9, 2-methyl- | HY-N1739 | Anthraquin...SMILES: CC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=OInChIKey: NJWGQARXZDRHCD-UHFFFAOYSA-NInChI: InChI=1S/C15H10O2/c1-9-6-7-12-13(8-9)15(17)11-5-3-2-4-10(11)14(12)16/h2-8H,1H3
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2-Methoxy-¹³C,d₃-estrone
Cas Number: 1217460-84-8Formula: C19H24O3Molecular weight: 301.4Synonyms: (8R,9S,13S,14S)-3-Hydroxy-2-(113C)methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]p...SMILES: CC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)OC)OInChIKey: WHEUWNKSCXYKBU-IQEHBMMRSA-NInChI: InChI=1S/C19H24O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,20H,3-8H2,1-2H3/t12-,13+,15-,19-/m0/s1/i2+1
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3-Fluoro-4-iodophenol
Cas Number: 122927-84-8Formula: C6H4FIOMolecular weight: 238.00Synonyms: 3-FLUORO-4-IODOPHENOL|122927-84-8|Phenol, 3-fluoro-4-iodo-|MFCD12407087|3-Floro-4-iodophenol|SCHEMBL...SMILES: C1=CC(=C(C=C1O)F)IInChIKey: CSQWLXZVUXRZFL-UHFFFAOYSA-NInChI: InChI=1S/C6H4FIO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H
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Amarogentin, Agonist of TAS2R30;Agonist of TAS2R43;Agonist of TAS2R46;Agonist of TAS2R50
Cas Number: 21018-84-8Formula: C29H30O13Molecular weight: 586.54Synonyms: Amarogentin|21018-84-8|5L82GT5I0W|[(2S,3R,4S,5S,6R)-2-[[(3S,4R,4aS)-4-ethenyl-8-oxo-4,4a,5,6-tetrahy...SMILES: C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)OC(=O)C4=C(C=C(C=C4O)O)C5=CC(=CC=C5)OInChIKey: DBOVHQOUSDWAPQ-WTONXPSSSA-NInChI: See more
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1,4-Dithia-7-azaspiro[4.5]decane, HCl
Cas Number: 958451-84-8Formula: C7H14ClNS2Molecular weight: 211.8Synonyms: 958451-84-8|1,4-Dithia-7-azaspiro[4.5]decane hydrochloride|1,4-Dithia-7-aza-spiro[4.5]decane hydroch...SMILES: C1CC2(CNC1)SCCS2.ClInChIKey: WWUSHZFMPSKSHJ-UHFFFAOYSA-NInChI: InChI=1S/C7H13NS2.ClH/c1-2-7(6-8-3-1)9-4-5-10-7;/h8H,1-6H2;1H
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L-Aspartic acid
Formula: C4H7NO4Molecular weight: 133.10Synonyms: L-aspartic acid|aspartic acid|56-84-8|H-Asp-OH|Asparagic acid|(2S)-2-aminobutanedioic acid|L-asparta...SMILES: N[C@@H](CC(O)=O)C(O)=OInChIKey: CKLJMWTZIZZHCS-REOHCLBHSA-NInChI: InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
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2-(1H-Benzo[d][1,2,3]triazol-1-yl)ethanamine hydrochloride
Cas Number: 2690-84-8Formula: C8H11ClN4Molecular weight: 198.65Synonyms: 2690-84-8|2-(1H-BENZO[D][1,2,3]TRIAZOL-1-YL)ETHANAMINE HYDROCHLORIDE|2-(benzotriazol-1-yl)ethanamine...SMILES: C1=CC=C2C(=C1)N=NN2CCN.ClInChIKey: OXHKIAMMEZKUST-UHFFFAOYSA-NInChI: InChI=1S/C8H10N4.ClH/c9-5-6-12-8-4-2-1-3-7(8)10-11-12;/h1-4H,5-6,9H2;1H
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2-[Benzo(b)thiophen-2-yl]-5-hydroxypyridine
Cas Number: 1261998-84-8Formula: C13H9NOSMolecular weight: 227.3Synonyms: 1261998-84-8|6-(Benzo[b]thiophen-2-yl)pyridin-3-ol|2-[Benzo(b)thiophen-2-yl]-5-hydroxypyridine|6-(1-...SMILES: C1=CC=C2C(=C1)C=C(S2)C3=NC=C(C=C3)OInChIKey: RTRDZUIOYHWHQF-UHFFFAOYSA-NInChI: InChI=1S/C13H9NOS/c15-10-5-6-11(14-8-10)13-7-9-3-1-2-4-12(9)16-13/h1-8,15H
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5-Bromo-2-((3-((tert-butyldimethylsilyloxy)methyl)pyrrolidin-1-yl)methyl)-3-methoxypyridine
Cas Number: 1186310-84-8Formula: C18H31BrN2O2SiMolecular weight: 415.4Synonyms: 1186310-84-8|5-Bromo-2-((3-((tert-butyldimethylsilyloxy)methyl)pyrrolidin-1-yl)methyl)-3-methoxypyri...SMILES: CC(C)(C)[Si](C)(C)OCC1CCN(C1)CC2=C(C=C(C=N2)Br)OCInChIKey: YGGQFKNSXKOLDC-UHFFFAOYSA-NInChI: InChI=1S/C18H31BrN2O2Si/c1-18(2,3)24(5,6)23-13-14-7-8-21(11-14)12-16-17(22-4)9-15(19)10-20-16/h9-10,14H,7-8,11-13H2,1-6H3
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trans-9-Octadecenoic methyl ester
Cas Number: 2462-84-2Formula: C19H36O2Molecular weight: 296.49Synonyms: METHYL ELAIDATE|1937-62-8|Elaidic acid methyl ester|methyl octadec-9-enoate|2462-84-2|Methyl trans-9...SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCInChIKey: QYDYPVFESGNLHU-ZHACJKMWSA-NInChI: InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-9,12-18H2,1-2H3/b11-10+
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(3-Fluoro-2-methoxypyridin-4-yl)boronic acid(contains varying amounts of Anhydride)
Cas Number: 1598387-84-8 EC Number: 882-914-7Formula: C6H7BNO3FMolecular weight: 170.93Synonyms: (3-fluoro-2-methoxy-4-pyridyl)boronic acid | F17107 | 2-Methoxy-3-cluoropyridine-4-boronicacid | AKO...SMILES: B(C1=C(C(=NC=C1)OC)F)(O)OInChIKey: GEAQIISIRPULKJ-UHFFFAOYSA-NInChI: InChI=1S/C6H7BFNO3/c1-12-6-5(8)4(7(10)11)2-3-9-6/h2-3,10-11H,1H3
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MDL 28170
Cas Number: 88191-84-8(DMSO)Formula: C22H26N2O4Molecular weight: 382.45Synonyms: Calpain Inhibitor III|88191-84-8|MDL-28170|Calpain Inhibitor III, MDL 28170|benzyl N-[(2s)-3-methyl-...SMILES: CC(C)C(C(=O)NC(CC1=CC=CC=C1)C=O)NC(=O)OCC2=CC=CC=C2InChIKey: NGBKFLTYGSREKK-ANYOKISRSA-NInChI: InChI=1S/C22H26N2O4/c1-16(2)20(24-22(27)28-15-18-11-7-4-8-12-18)21(26)23-19(14-25)13-17-9-5-3-6-10-17/h3-12,14,16,19-20H,13,15H2,1-2H3,(H,23,26)(H,24,27)/t19?,20-/m0/s1
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tert-Butyl 2,6-diazaspiro[3.4]octane-2-carboxylate
Cas Number: 885270-84-8Formula: C11H20N2O2Molecular weight: 212.29Synonyms: 885270-84-8|Tert-butyl 2,6-diazaspiro[3.4]octane-2-carboxylate|2-Boc-2,6-diazaspiro[3.4]octane|2,6-D...SMILES: CC(C)(C)OC(=O)N1CC2(C1)CCNC2InChIKey: UJIOQJJFPYXAEM-UHFFFAOYSA-NInChI: InChI=1S/C11H20N2O2/c1-10(2,3)15-9(14)13-7-11(8-13)4-5-12-6-11/h12H,4-8H2,1-3H3
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Benzo[b]thiophen-10-methoxycycloheptanone
Cas Number: 59743-84-9Formula: C14H10O2SMolecular weight: 242.3Synonyms: 59743-84-9|10-Methoxy-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-one|Benzo[b]thiophen-10-methoxycycloh...SMILES: COC1=CC2=CC=CC=C2C(=O)C3=C1SC=C3InChIKey: ZSGIVIUNURDDJL-UHFFFAOYSA-NInChI: InChI=1S/C14H10O2S/c1-16-12-8-9-4-2-3-5-10(9)13(15)11-6-7-17-14(11)12/h2-8H,1H3
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6-Ethoxy-1-ethylbenzimidazole
Cas Number: 1311197-84-8Formula: C11H14N2OMolecular weight: 190.2Synonyms: 6-Ethoxy-1-ethylbenzimidazole|1311197-84-8|6-Ethoxy-1-ethyl-1H-benzo[d]imidazole|6-Ethoxy-1-ethyl-1H...SMILES: CCN1C=NC2=C1C=C(C=C2)OCCInChIKey: JPBWAIFVLOIJSZ-UHFFFAOYSA-NInChI: InChI=1S/C11H14N2O/c1-3-13-8-12-10-6-5-9(14-4-2)7-11(10)13/h5-8H,3-4H2,1-2H3
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