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Search results for: '888-71-1'
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3,5-diphenyl-1,2,4-oxadiazole
Cas Number: 888-71-1Formula: C14H10N2OMolecular weight: 222.25SMILES: C1=CC=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3InChIKey: VIZNDSYPXQJMCM-UHFFFAOYSA-NInChI: InChI=1S/C14H10N2O/c1-3-7-11(8-4-1)13-15-14(17-16-13)12-9-5-2-6-10-12/h1-10H
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FK 888, Antagonist of NK 1 receptor;Antagonist of NK 2 receptor
Cas Number: 138449-07-7Formula: C36H36N4O4Molecular weight: 588.69Synonyms: DTXSID70160680 | (4R)-4-Hydroxy-1-[(1-methyl-1H-indol-3-yl)carbonyl]-L-prolyl-N-methyl-3-(2-naphthal...SMILES: CN1C=C(C2=CC=CC=C21)C(=O)N3CC(CC3C(=O)NC(CC4=CC5=CC=CC=C5C=C4)C(=O)N(C)CC6=CC=CC=C6)OInChIKey: BFNKQTIJVFGCKQ-PDJGWCFMSA-NInChI: See more
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Veliparib (ABT-888), PARP 1, 2 and 3 inhibitor
Cas Number: 912444-00-9(DMSO)Formula: C13H16N4OMolecular weight: 244.29Synonyms: NSC 737664 | (R)-2-(2-methylpyrrolidin-2-yl)-1H-benzo[d]imidazole-4-carboxamideSMILES: CC1(CCCN1)C2=NC3=C(C=CC=C3[NH]2)C(N)=O
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1-(P-TOLYL)-1-CYCLOHEXANECARBONITRILE
Cas Number: 1206-13-9Formula: C14H17NMolecular weight: 199.298Synonyms: 1206-13-9|1-(4-Methylphenyl)cyclohexanecarbonitrile|1-(p-Tolyl)cyclohexanecarbonitrile|1-(4-METHYLPH...SMILES: CC1=CC=C(C=C1)C2(CCCCC2)C#NInChIKey: JFUXEEYLCATFIB-UHFFFAOYSA-NInChI: InChI=1S/C14H17N/c1-12-5-7-13(8-6-12)14(11-15)9-3-2-4-10-14/h5-8H,2-4,9-10H2,1H3
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1,2,3-Trichloropropene (cis- and trans- mixture)
Cas Number: 96-19-5Formula: C3H3Cl3Molecular weight: 145.41Synonyms: NSC 164001 | MFCD00018931 | WLN: G1YGU1G | 1,2,3-Trichlor-1-propene | Crystolon 39 | Cis-1,2,3-trich...SMILES: C(C(=CCl)Cl)ClInChIKey: HIILBTHBHCLUER-IWQZZHSRSA-NInChI: InChI=1S/C3H3Cl3/c4-1-3(6)2-5/h1H,2H2/b3-1-
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PU-H71
Cas Number: 873436-91-0Formula: C18H21IN6O2SMolecular weight: 512.37Synonyms: PU-H71|873436-91-0|Zelavespib|PU-H 71|PU H71|PUH-71|PU-H-71|8-((6-Iodobenzo[d][1,3]dioxol-5-yl)thio)...SMILES: CC(C)NCCCN1C2=NC=NC(=C2N=C1SC3=C(C=C4C(=C3)OCO4)I)NInChIKey: SUPVGFZUWFMATN-UHFFFAOYSA-NInChI: InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23)
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PU-H71 XHBr
Cas Number: 873436-91-0(free)Formula: C18H21IN6O2S XHBrMolecular weight: 512.37(free)Synonyms: PU-H71|873436-91-0|Zelavespib|PU-H 71|PU H71|PUH-71|PU-H-71|8-((6-Iodobenzo[d][1,3]dioxol-5-yl)thio)...SMILES: CC(C)NCCCN1C2=NC=NC(=C2N=C1SC3=C(C=C4C(=C3)OCO4)I)NInChIKey: SUPVGFZUWFMATN-UHFFFAOYSA-NInChI: InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23)
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(2S)-1-methylpiperazine-2-carboxylic acid;dihydrochloride
Cas Number: 2306249-71-6Synonyms: 2306249-71-6 | (2S)-1-methylpiperazine-2-carboxylic acid | dihydrochloride | (2S)-1-METHYLPIPERAZINE...SMILES: CN1CCNCC1C(=O)O.Cl.ClInChIKey: DSADJSWCEFUWHA-XRIGFGBMSA-NInChI: InChI=1S/C6H12N2O2.2ClH/c1-8-3-2-7-4-5(8)6(9)10;;/h5,7H,2-4H2,1H3,(H,9,10);2*1H/t5-;;/m0../s1
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2-Chloro-1-ethoxy-4-nitrobenzene
Cas Number: 5493-71-0Formula: C8H8ClNO3Molecular weight: 201.6Synonyms: 2-CHLORO-1-ETHOXY-4-NITROBENZENE|5493-71-0|SCHEMBL6816187|DTXSID00559189|MFCD15143590|AKOS015849960|...SMILES: CCOC1=C(C=C(C=C1)[N+](=O)[O-])ClInChIKey: VKLNEPUDOYKJDE-UHFFFAOYSA-NInChI: InChI=1S/C8H8ClNO3/c1-2-13-8-4-3-6(10(11)12)5-7(8)9/h3-5H,2H2,1H3
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F3, Gating inhibitor of K ir3.2
Cas Number: 661-71-2Formula: C4H4ClF3Molecular weight: 144.52Synonyms: 1-Chloro-1,2,2-trifluorocyclobutane|661-71-2|Cyclobutane, 1-chloro-1,2,2-trifluoro-|1-Ctfcb|GTPL2400...SMILES: C1CC(C1(F)F)(F)ClInChIKey: ZZQYDYODFHABLC-UHFFFAOYSA-NInChI: InChI=1S/C4H4ClF3/c5-3(6)1-2-4(3,7)8/h1-2H2
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1-methyl-1H-pyrrolo[3,2-b]pyridin-6-ol
Cas Number: 2231675-71-9Formula: C8H8N2OMolecular weight: 148.16Synonyms: 1-methyl-1H-pyrrolo[3,2-b]pyridin-6-ol | 2231675-71-9 | MFCD31705017 | PB42069 | E79913SMILES: CN1C=CC2=C1C=C(C=N2)OInChIKey: AYSNBYSFUPALMI-UHFFFAOYSA-NInChI: InChI=1S/C8H8N2O/c1-10-3-2-7-8(10)4-6(11)5-9-7/h2-5,11H,1H3
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4,5-diiodo-1-methyl-triazole
Cas Number: 1248676-71-2Formula: C3H3N3I2Molecular weight: 334.88Synonyms: 4,5-diiodo-1-methyl-triazole | 1248676-71-2 | 4,5-Diiodo-1-methyl-1H-1,2,3-triazole | 4,5-diiodo-1-m...SMILES: CN1C(=C(N=N1)I)IInChIKey: GYGVGFXHSWIJRC-UHFFFAOYSA-NInChI: InChI=1S/C3H3I2N3/c1-8-3(5)2(4)6-7-8/h1H3
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1-(Hydroxymethyl)cyclopropaneacetonitrile
Cas Number: 152922-71-9Formula: C6H9NOMolecular weight: 111.1Synonyms: 152922-71-9|1-(Hydroxymethyl)cyclopropaneacetonitrile|2-(1-(Hydroxymethyl)cyclopropyl)acetonitrile|2...SMILES: C1CC1(CC#N)COInChIKey: WYOMLUMUVAPMKE-UHFFFAOYSA-NInChI: InChI=1S/C6H9NO/c7-4-3-6(5-8)1-2-6/h8H,1-3,5H2
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3-iodo-1-methyl-1H-pyrrolo[2,3-b]pyridine
Cas Number: 260431-71-8Formula: C8H7IN2Molecular weight: 258.06Synonyms: 3-iodo-1-methyl-1H-pyrrolo[2,3-b]pyridine | 260431-71-8 | SCHEMBL14197833 | MFCD18254000 | SB14168 |...SMILES: CN1C=C(C2=C1N=CC=C2)IInChIKey: AWSQFYGAAAQKFU-UHFFFAOYSA-NInChI: InChI=1S/C8H7IN2/c1-11-5-7(9)6-3-2-4-10-8(6)11/h2-5H,1H3
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3-Acetylphenyl isothiocyanate
Cas Number: 3125-71-1Formula: C9H7NOSMolecular weight: 177.23Synonyms: 3-Acetylphenyl Isothiocyanate|3125-71-1|1-(3-Isothiocyanatophenyl)ethanone|3-Acetylphenylisothiocyan...SMILES: CC(=O)C1=CC(=CC=C1)N=C=SInChIKey: RGANVWCPAAIVNN-UHFFFAOYSA-NInChI: InChI=1S/C9H7NOS/c1-7(11)8-3-2-4-9(5-8)10-6-12/h2-5H,1H3
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1-(4-Iodophenyl)ethan-1-amine hydrochloride
Cas Number: 1955515-71-5Formula: C8H11ClINMolecular weight: 283.54Synonyms: 1-(4-iodophenyl)ethan-1-amine hydrochloride|1955515-71-5|SCHEMBL22345010|AKOS032947589|SB44392|SB821...SMILES: CC(C1=CC=C(C=C1)I)N.ClInChIKey: PZYFIOFVFANOJA-UHFFFAOYSA-NInChI: InChI=1S/C8H10IN.ClH/c1-6(10)7-2-4-8(9)5-3-7;/h2-6H,10H2,1H3;1H
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1,1-cyclobutanedimethanamine
Cas Number: 38932-71-7Formula: C6H14N2Molecular weight: 114.1888Synonyms: 1,1-Cyclobutanedimethanamine|38932-71-7|[1-(aminomethyl)cyclobutyl]methanamine|cyclobutane-1,1-diyld...SMILES: C1CC(C1)(CN)CNInChIKey: OBEQILXWAPILBH-UHFFFAOYSA-NInChI: InChI=1S/C6H14N2/c7-4-6(5-8)2-1-3-6/h1-5,7-8H2
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tert-butyl 2-methyl-4-oxo-azepane-1-carboxylate
Cas Number: 2035418-71-2Formula: C12H21NO3Molecular weight: 227.3Synonyms: 2035418-71-2 | tert-Butyl 2-methyl-4-oxoazepane-1-carboxylate | tert-butyl 2-methyl-4-oxo-azepane-1-...SMILES: CC1CC(=O)CCCN1C(=O)OC(C)(C)CInChIKey: WWOXIDDANMMCNY-UHFFFAOYSA-NInChI: InChI=1S/C12H21NO3/c1-9-8-10(14)6-5-7-13(9)11(15)16-12(2,3)4/h9H,5-8H2,1-4H3
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3-Amino-1-methanesulfonylpyrrolidine
Cas Number: 662116-71-4Formula: C5H12N2O2SMolecular weight: 164.2Synonyms: 3-AMINO-1-METHANESULFONYLPYRROLIDINE|662116-71-4|1-(METHYLSULFONYL)PYRROLIDIN-3-AMINE|1-methylsulfon...SMILES: CS(=O)(=O)N1CCC(C1)NInChIKey: UDYSDVVJHGYAHB-UHFFFAOYSA-NInChI: InChI=1S/C5H12N2O2S/c1-10(8,9)7-3-2-5(6)4-7/h5H,2-4,6H2,1H3
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2-fluorocyclobutane-1-carboxylic acid
Cas Number: 1785331-71-6 EC Number: 827-893-7Formula: C5H7FO2Molecular weight: 118.11Synonyms: 2-fluorocyclobutane-1-carboxylic acid | 2-Fluorocyclobutanecarboxylic Acid | 2-fluorocyclobutane-1-c...SMILES: C1CC(C1C(=O)O)FInChIKey: LYQXOYIXLKILCQ-UHFFFAOYSA-NInChI: InChI=1S/C5H7FO2/c6-4-2-1-3(4)5(7)8/h3-4H,1-2H2,(H,7,8)
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tert-butyl N-(1-pyrazin-2-ylcyclopropyl)carbamate
Cas Number: 2809035-71-8Formula: C12H17N3O2Molecular weight: 235.28Synonyms: 1-(Boc-amino)-1-pyrazin-2-ylcyclopropane | F78153 | tert-Butyl (1-(pyrazin-2-yl)cyclopropyl)carbamat...SMILES: CC(C)(C)OC(=O)NC1(CC1)C2=NC=CN=C2InChIKey: VIPYSDKANWRVBN-UHFFFAOYSA-NInChI: InChI=1S/C12H17N3O2/c1-11(2,3)17-10(16)15-12(4-5-12)9-8-13-6-7-14-9/h6-8H,4-5H2,1-3H3,(H,15,16)
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1-Phenylcyclohexylamine hydrochloride
Cas Number: 1934-71-0Formula: C12H18ClNMolecular weight: 211.73Synonyms: 1-Phenylcyclohexylamine hydrochloride|1934-71-0|1-phenylcyclohexanamine hydrochloride|CI 401|1-pheny...SMILES: C1CCC(CC1)(C2=CC=CC=C2)N.ClInChIKey: AFQRMCRVQVUGMF-UHFFFAOYSA-NInChI: InChI=1S/C12H17N.ClH/c13-12(9-5-2-6-10-12)11-7-3-1-4-8-11;/h1,3-4,7-8H,2,5-6,9-10,13H2;1H
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(2S,3S)-1-benzhydryl-2-methyl-azetidin-3-amine
Cas Number: 164906-71-2Formula: C17H20N2Molecular weight: 252.35Synonyms: (2S,3S)-1-benzhydryl-2-methyl-azetidin-3-amine | 164906-71-2 | (2S,3S)-1-benzhydryl-2-methylazetidin...SMILES: CC1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)NInChIKey: CJCQBRZYAQTEOO-BBRMVZONSA-NInChI: InChI=1S/C17H20N2/c1-13-16(18)12-19(13)17(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16-17H,12,18H2,1H3/t13-,16-/m0/s1
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Pyridaben in Methanol
Cas Number: 96489-71-3 EC Number: 405-700-3Formula: C19H25ClN2OSMolecular weight: 364.93Synonyms: CAS-96489-71-3 | Pyramite | 2-t-butyl-5-(p-t-butylbenzylthio)-4-chloro-3(2H)-pyridazinone | AKOS0158...SMILES: CC(C)(C)C1=CC=C(C=C1)CSC2=C(C(=O)N(N=C2)C(C)(C)C)ClInChIKey: DWFZBUWUXWZWKD-UHFFFAOYSA-NInChI: InChI=1S/C19H25ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7-11H,12H2,1-6H3
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