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Search results for: '51580-86-0'
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Sodium dichloroisocyanurate dihydrat
Cas Number: 51580-86-0Formula: C3Cl2N3NaO3·2H2OMolecular weight: 255.98Synonyms: NaDCC | Troclosene sodium dihydrate | UNII-8027SYQ9X3 | CAS-51580-86-0 | AS-83573 | DTXCID509761 | S...SMILES: C1(=NC(=O)N(C(=O)N1Cl)Cl)[O-].O.O.[Na+]InChIKey: PYILKOIEIHHYGD-UHFFFAOYSA-MInChI: InChI=1S/C3HCl2N3O3.Na.2H2O/c4-7-1(9)6-2(10)8(5)3(7)11;;;/h(H,6,9,10);;2*1H2/q;+1;;/p-1
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Bedaquiline fumarate, ATP synthase inhibitor
Cas Number: 845533-86-0Formula: C32H31BrN2O2.C4H4O4Molecular weight: 671.58Synonyms: Bedaquiline fumarate|845533-86-0|Sirturo|Bedaquiline (fumarate)|R403323|UNII-P04QX2C1A5|Bedaquiline ...SMILES: CN(C)CCC(C1=CC=CC2=CC=CC=C21)(C(C3=CC=CC=C3)C4=C(N=C5C=CC(=CC5=C4)Br)OC)O.C(=CC(=O)O)C(=O)OInChIKey: ZLVSPMRFRHMMOY-WWCCMVHESA-NInChI: See more
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methyl pyrrolo[2,1-f][1,2,4]triazine-2-carboxylate
Cas Number: 2106690-86-0Formula: C8H7N3O2Molecular weight: 177.16Synonyms: methyl pyrrolo[2,1-f][1,2,4]triazine-2-carboxylate | 2106690-86-0 | F89198SMILES: COC(=O)C1=NN2C=CC=C2C=N1InChIKey: YJEREMVSBMBEHV-UHFFFAOYSA-NInChI: InChI=1S/C8H7N3O2/c1-13-8(12)7-9-5-6-3-2-4-11(6)10-7/h2-5H,1H3
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n-Butylethylmagnesium
Cas Number: 62202-86-2(Heptane)Formula: C6H14MgMolecular weight: 110.48Synonyms: Magnesium, butylethyl-|n-butylethylmagnesium|62202-86-2|Butylethylmagnesium|magnesium;butane;ethane|...SMILES: C[CH2-].CCC[CH2-].[Mg+2]InChIKey: YHNWUQFTJNJVNU-UHFFFAOYSA-NInChI: InChI=1S/C4H9.C2H5.Mg/c1-3-4-2;1-2;/h1,3-4H2,2H3;1H2,2H3;/q2*-1;+2
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5-Cyclohexyl-3-(3-nitrophenyl)-1,2,4-oxadiazole
Cas Number: 442571-86-0Formula: C14H15N3O3Molecular weight: 273.3Synonyms: 5-cyclohexyl-3-(3-nitrophenyl)-1,2,4-oxadiazole|442571-86-0|DTXSID00351544|MFCD04208216|STK114848|AK...SMILES: C1CCC(CC1)C2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]InChIKey: WQLIQMGJEJUWCQ-UHFFFAOYSA-NInChI: InChI=1S/C14H15N3O3/c18-17(19)12-8-4-7-11(9-12)13-15-14(20-16-13)10-5-2-1-3-6-10/h4,7-10H,1-3,5-6H2
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Phensuximide, Voltage-gated T-type calcium channel blocker
Formula: C11H11NO2Molecular weight: 189.21Synonyms: Phensuximide|86-34-0|Milontin|Succitimal|Lifene|Epimid|Phensuximid|Phenylsuximide|Milonton|1-methyl-...SMILES: CN1C(=O)CC(C1=O)C2=CC=CC=C2InChIKey: WLWFNJKHKGIJNW-UHFFFAOYSA-NInChI: InChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
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Mefloquine Hydrochloride
Cas Number: 51773-92-3Formula: C17H16F6N2O·HClMolecular weight: 414.78Synonyms: Mefloquine hydrochloride|Mefloquine HCL|51773-92-3|Mephaquin|Loriam|WR 142490 hydrochloride|Ro 21-59...SMILES: C1CCNC(C1)C(C2=CC(=NC3=C2C=CC=C3C(F)(F)F)C(F)(F)F)O.ClInChIKey: WESWYMRNZNDGBX-YLCXCWDSSA-NInChI: InChI=1S/C17H16F6N2O.ClH/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11;/h3-5,8,12,15,24,26H,1-2,6-7H2;1H/t12-,15+;/m1./s1
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4-Diphenylmethoxypiperidine, HCl
Cas Number: 65214-86-0Formula: C18H21NO.ClHMolecular weight: 303.8Synonyms: 4-Diphenylmethoxypiperidine hydrochloride|65214-86-0|4-(diphenylmethoxy)piperidine hydrochloride|4-b...SMILES: C1CNCCC1OC(C2=CC=CC=C2)C3=CC=CC=C3.ClInChIKey: HXROHDYGZFFVMO-UHFFFAOYSA-NInChI: InChI=1S/C18H21NO.ClH/c1-3-7-15(8-4-1)18(16-9-5-2-6-10-16)20-17-11-13-19-14-12-17;/h1-10,17-19H,11-14H2;1H
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8-ethynyl-1,4-dioxaspiro[4.5]decane
Cas Number: 96184-86-0Formula: C10H14O2Molecular weight: 166.22Synonyms: 8-ethynyl-1,4-dioxaspiro[4.5]decane | 96184-86-0 | MFCD25972927 | 4-ethynyl-1,1-ethylenedioxycyclohe...SMILES: C#CC1CCC2(CC1)OCCO2InChIKey: KLQRERRXSGHFPC-UHFFFAOYSA-NInChI: InChI=1S/C10H14O2/c1-2-9-3-5-10(6-4-9)11-7-8-12-10/h1,9H,3-8H2
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3,5-dibromo-1H-pyrazole
Cas Number: 67460-86-0Formula: C3H2Br2N2Molecular weight: 225.87Synonyms: 3,5-dibromo-1H-pyrazole|67460-86-0|3,5-Dibromopyrazole|1H-Pyrazole, 3,5-dibromo-|MFCD00159645|dibrom...SMILES: C1=C(NN=C1Br)BrInChIKey: UQFIWKBFQXGMJD-UHFFFAOYSA-NInChI: InChI=1S/C3H2Br2N2/c4-2-1-3(5)7-6-2/h1H,(H,6,7)
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(4-ethylcyclohexyl)methanol
Cas Number: 113296-33-6Formula: C9H18OMolecular weight: 142.24Synonyms: (4-ethylcyclohexyl)methanol | 113296-33-6 | trans-4-Ethyl-cyclohexanemethanol | Cyclohexanemethanol,...SMILES: CCC1CCC(CC1)COInChIKey: YSQZCEWPPUAANL-UHFFFAOYSA-NInChI: InChI=1S/C9H18O/c1-2-8-3-5-9(7-10)6-4-8/h8-10H,2-7H2,1H3
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4,4-Dimethyl-1,2,3,4-tetrahydroisoquinoline hydrochloride
Cas Number: 41565-86-0Formula: C11H16ClNMolecular weight: 197.7Synonyms: 41565-86-0|4,4-Dimethyl-1,2,3,4-tetrahydroisoquinoline hydrochloride|4,4-Dimethyl-1,2,3,4-tetrahydro...SMILES: CC1(CNCC2=CC=CC=C21)C.ClInChIKey: GKEXKZRMVZSSPD-UHFFFAOYSA-NInChI: InChI=1S/C11H15N.ClH/c1-11(2)8-12-7-9-5-3-4-6-10(9)11;/h3-6,12H,7-8H2,1-2H3;1H
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2,8-diazaspiro[4.5]decan-3-one;dihydrochloride
Cas Number: 1417301-86-0 EC Number: 800-650-2Formula: C8H14N2O·2[HCl]Molecular weight: 227.13Synonyms: E80119 | AKOS027426429 | 1417301-86-0 | 2,8-Diazaspiro[4.5]decan-3-one dihydrochloride | 2,8-diazasp...SMILES: C1CNCCC12CC(=O)NC2.Cl.ClInChIKey: PUGNXFYCUYCIAW-UHFFFAOYSA-NInChI: InChI=1S/C8H14N2O.2ClH/c11-7-5-8(6-10-7)1-3-9-4-2-8;;/h9H,1-6H2,(H,10,11);2*1H
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6-Bromo-3-cyclopropyl-1-methylindazole
Cas Number: 1311197-86-0Formula: C11H11BrN2Molecular weight: 251.1Synonyms: 1311197-86-0|6-Bromo-3-cyclopropyl-1-methyl-1H-indazole|6-Bromo-3-cyclopropyl-1-methylindazole|DTXSI...SMILES: CN1C2=C(C=CC(=C2)Br)C(=N1)C3CC3InChIKey: AOHMWGQFUZQXIN-UHFFFAOYSA-NInChI: InChI=1S/C11H11BrN2/c1-14-10-6-8(12)4-5-9(10)11(13-14)7-2-3-7/h4-7H,2-3H2,1H3
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N-Boc-piperazine-d8
Cas Number: 1126621-86-0Formula: C9H10D8N2O2Molecular weight: 194.30Synonyms: 1126621-86-0 | AS-78680 | Piperazine-d8-N-t-BOC | tert-butyl 2,2,3,3,5,5,6,6-octadeuteriopiperazine-...SMILES: CC(C)(C)OC(=O)N1CCNCC1InChIKey: CWXPZXBSDSIRCS-DUSUNJSHSA-NInChI: InChI=1S/C9H18N2O2/c1-9(2,3)13-8(12)11-6-4-10-5-7-11/h10H,4-7H2,1-3H3/i4D2,5D2,6D2,7D2
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cis-benzyl 3-hydroxycyclobutylcarbamate
Cas Number: 1403766-86-8Formula: C12H15NO3Molecular weight: 221.256Synonyms: cis-Benzyl 3-hydroxycyclobutylcarbamate|130396-60-0|1403766-86-8|trans-Benzyl 3-hydroxycyclobutylcar...SMILES: C1C(CC1O)NC(=O)OCC2=CC=CC=C2InChIKey: BCFMGQOQYWGLIL-UHFFFAOYSA-NInChI: InChI=1S/C12H15NO3/c14-11-6-10(7-11)13-12(15)16-8-9-4-2-1-3-5-9/h1-5,10-11,14H,6-8H2,(H,13,15)
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1-Formylpiperidine
Formula: C6H11NOMolecular weight: 113.16Synonyms: SCHEMBL2638 | FORMYLPIPERIDIDE | AMY3400 | F0234 | Piperidinoformamide | CAS-2591-86-8 | N-Formylpip...SMILES: C1CCN(CC1)C=OInChIKey: FEWLNYSYJNLUOO-UHFFFAOYSA-NInChI: InChI=1S/C6H11NO/c8-6-7-4-2-1-3-5-7/h6H,1-5H2
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3-Amino-4-methylbenzamide
Cas Number: 19406-86-1Formula: C8H10N2OMolecular weight: 150.18Synonyms: Q27260927 | Tox21_302118 | 2-(1-CARBAMOYLMETHYL-CYCLOHEXYL)-ACETAMIDE | EN300-59606 | CAS-19406-86-1...SMILES: CC1=C(C=C(C=C1)C(=O)N)NInChIKey: VYBKAZXQKUFAHG-UHFFFAOYSA-NInChI: InChI=1S/C8H10N2O/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,9H2,1H3,(H2,10,11)
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2-Chlorocyclohexanol
Cas Number: 1561-86-0Formula: C6H11ClOMolecular weight: 134.6Synonyms: 2-CHLOROCYCLOHEXANOL|1561-86-0|2-chlorocyclohexan-1-ol|Cyclohexanol, 2-chloro-|MFCD00003860|Cyclohex...SMILES: C1CCC(C(C1)O)ClInChIKey: NYEWDMNOXFGGDX-UHFFFAOYSA-NInChI: InChI=1S/C6H11ClO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4H2
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Amodiaquine
Cas Number: 86-42-0Formula: C20H22ClN3OMolecular weight: 355.86Synonyms: amodiaquine|86-42-0|Amodiaquin|Flavoquine|Camoquin|Camoquine|Camochin|Camoquinal|Miaquin|Amodiaquinu...SMILES: CCN(CC)CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)OInChIKey: OVCDSSHSILBFBN-UHFFFAOYSA-NInChI: InChI=1S/C20H22ClN3O/c1-3-24(4-2)13-14-11-16(6-8-20(14)25)23-18-9-10-22-19-12-15(21)5-7-17(18)19/h5-12,25H,3-4,13H2,1-2H3,(H,22,23)
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4-bromo-2,5-dimethyl-indazole
Cas Number: 1159511-86-0Formula: C9H9N2BrMolecular weight: 225.08Synonyms: 4-bromo-2,5-dimethylindazole | J-514607 | 4-Bromo-2,5-dimethyl-2H-indazole | W-204871 | 1159511-86-0...SMILES: CC1=C(C2=CN(N=C2C=C1)C)BrInChIKey: QHLAFXZSLHLHOT-UHFFFAOYSA-NInChI: InChI=1S/C9H9BrN2/c1-6-3-4-8-7(9(6)10)5-12(2)11-8/h3-5H,1-2H3
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benzyl N-(3-hydroxycyclobutyl)carbamate
Cas Number: 130396-60-0Formula: C12H15NO3Molecular weight: 221.256Synonyms: cis-Benzyl 3-hydroxycyclobutylcarbamate|130396-60-0|1403766-86-8|trans-Benzyl 3-hydroxycyclobutylcar...SMILES: C1C(CC1O)NC(=O)OCC2=CC=CC=C2InChIKey: BCFMGQOQYWGLIL-UHFFFAOYSA-NInChI: InChI=1S/C12H15NO3/c14-11-6-10(7-11)13-12(15)16-8-9-4-2-1-3-5-9/h1-5,10-11,14H,6-8H2,(H,13,15)
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Canagliflozin hemihydrate
Cas Number: 928672-86-0Formula: 2C24H25FO5S • (H2O)Molecular weight: 907.05Synonyms: canagliflozin hemihydrate|928672-86-0|Invokana|Canagliflozin hydrate|Cagliflozin hemihydrate|CHEBI:7...SMILES: CC1=C(C=C(C=C1)C2C(C(C(C(O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F.CC1=C(C=C(C=C1)C2C(C(C(C(O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F.OInChIKey: VHOFTEAWFCUTOS-TUGBYPPCSA-NInChI: InChI=1S/2C24H25FO5S.H2O/c2*1-13-2-3-15(24-23(29)22(28)21(27)19(12-26)30-24)10-16(13)11-18-8-9-20(31-18)14-4-6-17(25)7-5-14;/h2*2-10,19,21-24,26-29H,11-12H2,1H3;1H2/t2*19-,21-,22+,23-,24+;/m11./s1
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