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Search results for: '202-601-5'
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SPK-601
Cas Number: 1096687-52-3Formula: C11H15KOS2Molecular weight: 266.47Synonyms: CS-0333 | HY-70083 | Carbonodithioic acid, O-((3aR,4R,5S,7R,7aR)-octahydro-4,7-methano-1H-inden-5-yl...SMILES: C1CC2C(C1)C3CC2CC3OC(=S)[S-].[K+]InChIKey: IGULCCCBGBDZKQ-UATZLORTSA-MInChI: InChI=1S/C11H16OS2.K/c13-11(14)12-10-5-6-4-9(10)8-3-1-2-7(6)8;/h6-10H,1-5H2,(H,13,14);/q;+1/p-1/t6-,7-,8-,9-,10+;/m1./s1
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N-(5-Benzyl-thiazol-2-yl)-2-chloro-acetamide
Cas Number: 301306-13-8Formula: C12H11ClN2OSMolecular weight: 266.75Synonyms: N-(5-benzyl-1,3-thiazol-2-yl)-2-chloroacetamide|301306-13-8|N-(5-Benzyl-thiazol-2-yl)-2-chloro-aceta...SMILES: C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)CClInChIKey: JHXGLKACLBGNHG-UHFFFAOYSA-NInChI: InChI=1S/C12H11ClN2OS/c13-7-11(16)15-12-14-8-10(17-12)6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,14,15,16)
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Ethyl Thioacetate
Formula: C4H8OSMolecular weight: 104.17Synonyms: EINECS 261-601-3 | Ethyl thiolacetate | InChI=1/C4H8OS/c1-3-6-4(2)5/h3H2,1-2H | S-Ethyl thioacetate ...SMILES: CCSC(=O)CInChIKey: APTGPWJUOYMUCE-UHFFFAOYSA-NInChI: InChI=1S/C4H8OS/c1-3-6-4(2)5/h3H2,1-2H3
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5-Amino-2-benzimidazolinone
Cas Number: 95-23-8Formula: C7H7N3OMolecular weight: 149.15Synonyms: 5-Amino-1,3-dihydro-2H-benzimidazol-2-one, AldrichCPR | 2-BENZIMIDAZOLINONE, 5-AMINO- | 5-AMINO-1,3-...SMILES: C1=CC2=C(C=C1N)NC(=O)N2InChIKey: BCXSVFBDMPSKPT-UHFFFAOYSA-NInChI: InChI=1S/C7H7N3O/c8-4-1-2-5-6(3-4)10-7(11)9-5/h1-3H,8H2,(H2,9,10,11)
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1-Phenylethyl acetate
Cas Number: 93-92-5Formula: C10H12O2Molecular weight: 164.2Synonyms: .alpha.-Methylbenzyl alcohol, acetate | DS-6630 | SCHEMBL114793 | Styrallyl acetate | FEMA 2684 | FT...SMILES: CC(C1=CC=CC=C1)OC(=O)CInChIKey: QUMXDOLUJCHOAY-UHFFFAOYSA-NInChI: InChI=1S/C10H12O2/c1-8(12-9(2)11)10-6-4-3-5-7-10/h3-8H,1-2H3
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3,4-Dichlorotoluene
Formula: C7H6Cl2Molecular weight: 161.03Synonyms: 3,4-DCT | 1,2-Dichloro-4-methylbenzene # | Benzene, 1,2-dichloro-4-methyl- | NSC 8765 | EINECS 202-4...SMILES: CC1=CC(=C(C=C1)Cl)ClInChIKey: WYUIWKFIFOJVKW-UHFFFAOYSA-NInChI: InChI=1S/C7H6Cl2/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3
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razupenem, Bacterial penicillin-binding protein inhibitor
Cas Number: 426253-04-5Formula: C18H21N3O4S2Molecular weight: 407.5Synonyms: DTXSID801045429 | 26020H3Q1L | (4R,5S,6S)-6-((1R)-1-hydroxyethyl)-4-methyl-3-((4-((5S)-5-methyl-2,5-...SMILES: CC1C=C(CN1)C2=CSC(=N2)SC3=C(N4C(C3C)C(C4=O)C(C)O)C(=O)OInChIKey: XFGOMLIRJYURLQ-GOKYHWASSA-NInChI: InChI=1S/C18H21N3O4S2/c1-7-4-10(5-19-7)11-6-26-18(20-11)27-15-8(2)13-12(9(3)22)16(23)21(13)14(15)17(24)25/h4,6-9,12-13,19,22H,5H2,1-3H3,(H,24,25)/t7-,8+,9+,12+,13+/m0/s1
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Domatinostat (4SC-202)
Cas Number: 910462-43-0Formula: C23H21N5O3SMolecular weight: 447.51Synonyms: DB13101 | DOMATINOSTAT [WHO-DD] | HY-16012A | 4SC202 | 4SC-202 | 4SC-202 (free base) | AS-77606 | A8...SMILES: CN1C=C(C=N1)C2=CC=C(C=C2)S(=O)(=O)N3C=CC(=C3)C=CC(=O)NC4=CC=CC=C4NInChIKey: PRXXYMVLYKJITB-IZZDOVSWSA-NInChI: InChI=1S/C23H21N5O3S/c1-27-16-19(14-25-27)18-7-9-20(10-8-18)32(30,31)28-13-12-17(15-28)6-11-23(29)26-22-5-3-2-4-21(22)24/h2-16H,24H2,1H3,(H,26,29)/b11-6+
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L-(−)-Malic acid
Formula: C4H6O5Molecular weight: 134.09SMILES: C(C(C(=O)O)O)C(=O)OInChIKey: BJEPYKJPYRNKOW-REOHCLBHSA-NInChI: InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1
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Nebicapone, Catechol O-methyltransferase inhibitor
Cas Number: 274925-86-9Formula: C14H11NO5Molecular weight: 273.24Synonyms: Ethanone, 1-(3,4-dihydroxy-5-nitrophenyl)-2-phenyl- | BIA 3-202 | 1-(3,4-dihydroxy-5-nitro-phenyl)-2...SMILES: C1=CC=C(C=C1)CC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]InChIKey: MRFOLGFFTUGAEB-UHFFFAOYSA-NInChI: InChI=1S/C14H11NO5/c16-12(6-9-4-2-1-3-5-9)10-7-11(15(19)20)14(18)13(17)8-10/h1-5,7-8,17-18H,6H2
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Piperine
Formula: C17H19NO3Molecular weight: 285.34Synonyms: BSPBio_002515 | MLS002153830 | Piperine, >=97% | starbld0008505 | NSC757803 | NSC-757803 | Piperidin...SMILES: C1CCN(CC1)C(=O)C=CC=CC2=CC3=C(C=C2)OCO3InChIKey: MXXWOMGUGJBKIW-YPCIICBESA-NInChI: InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+
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cis-Dimethyl cyclohexane-1,4-dicarboxylate
Cas Number: 3399-21-1 EC Number: 202-347-5, 919-945-3, 678-252-1Formula: C10H16O4Molecular weight: 200.23Synonyms: EC 202-347-5 | NCGC00164087-01 | NCGC00164087-02 | Dimethyl cis-1,4-cyclohexanedicarboxylate | dimet...SMILES: COC(=O)C1CCC(CC1)C(=O)OCInChIKey: LNGAGQAGYITKCW-UHFFFAOYSA-NInChI: InChI=1S/C10H16O4/c1-13-9(11)7-3-5-8(6-4-7)10(12)14-2/h7-8H,3-6H2,1-2H3
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5-Nitro-2-furaldehyde Diacetate
Cas Number: 92-55-7Formula: C9H9NO7Molecular weight: 243.17Synonyms: UNII-7X0X1KNE3Q | DS-6423 | MFCD00003244 | EINECS 202-166-1 | 5-Nitrofurfural Diacetyl Acetal | 5-Ni...SMILES: CC(=O)OC(C1=CC=C(O1)[N+](=O)[O-])OC(=O)CInChIKey: HSXKWKJCZNRMJO-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO7/c1-5(11)15-9(16-6(2)12)7-3-4-8(17-7)10(13)14/h3-4,9H,1-2H3
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2,4-Dimethylbenzylamine
Cas Number: 94-98-4Formula: C9H13NMolecular weight: 135.21Synonyms: 2,4-Dimethylbenzylamine|94-98-4|(2,4-Dimethylphenyl)methanamine|Benzenemethanamine, 2,4-dimethyl-|2,...SMILES: CC1=CC(=C(C=C1)CN)CInChIKey: GBSUVYGVEQDZPG-UHFFFAOYSA-NInChI: InChI=1S/C9H13N/c1-7-3-4-9(6-10)8(2)5-7/h3-5H,6,10H2,1-2H3
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3-Hydroxybenzoic acid
Formula: C7H6O3Molecular weight: 138.12Synonyms: meta-hydroxybenzoate | 713EC407-4844-477D-8207-DBD66E398D2C | C00587 | 3-Carboxyphenol | NSC55746 | ...SMILES: C1=CC(=CC(=C1)O)C(=O)OInChIKey: IJFXRHURBJZNAO-UHFFFAOYSA-NInChI: InChI=1S/C7H6O3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H,(H,9,10)
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4-Amino-5-aminomethyl-2-methylpyrimidine
Cas Number: 95-02-3Formula: C6H10N4Molecular weight: 138.2Synonyms: EC 202-384-7 | AKOS005206902 | 2-methyl-4-amino-5-aminomethyl pyrimidine | 5-(Aminomethyl)-2-methyl-...SMILES: CC1=NC=C(C(=N1)N)CNInChIKey: OZOHTVFCSKFMLL-UHFFFAOYSA-NInChI: InChI=1S/C6H10N4/c1-4-9-3-5(2-7)6(8)10-4/h3H,2,7H2,1H3,(H2,8,9,10)
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Allantoin
Formula: C4H6N4O3Molecular weight: 158.12Synonyms: UNII-344S277G0Z | 5-Ureidohydantoin | 5-ureido-Hydantoin | EINECS 202-592-8 | MFCD00005260 | BL Vita...SMILES: C1(C(=O)NC(=O)N1)NC(=O)NInChIKey: POJWUDADGALRAB-UHFFFAOYSA-NInChI: InChI=1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11)
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α,α,α-Trichlorotoluene
Formula: C6H5CCl3Molecular weight: 195.47Synonyms: 4-05-00-00820 (Beilstein Handbook Reference) | alpha,alpha,alpha-Trichlorotoluene, analytical standa...SMILES: C1=CC=C(C=C1)C(Cl)(Cl)ClInChIKey: XEMRAKSQROQPBR-UHFFFAOYSA-NInChI: InChI=1S/C7H5Cl3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H
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2-Bromophenol
Formula: C6H5OBrMolecular weight: 173.01Synonyms: A845333 | DTXSID8052641 | o-Bromophenol | o-bromo-phenol | UNII-A0UB206YF0 | BROMOPHENOL | bromo-phe...SMILES: C1=CC=C(C(=C1)O)BrInChIKey: VADKRMSMGWJZCF-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrO/c7-5-3-1-2-4-6(5)8/h1-4,8H
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2-Chloro-5-nitrobenzenesulfonamide
Cas Number: 96-72-0Formula: C6H5ClN2O4SMolecular weight: 236.63Synonyms: 2-Chloro-5-nitrobenzenesulfonamide|96-72-0|Benzenesulfonamide, 2-chloro-5-nitro-|2-Chloro-5-nitroben...SMILES: C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)N)ClInChIKey: ZAJALNCZCSSGJC-UHFFFAOYSA-NInChI: InChI=1S/C6H5ClN2O4S/c7-5-2-1-4(9(10)11)3-6(5)14(8,12)13/h1-3H,(H2,8,12,13)
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1,3-Dihydroxyacetone
Cas Number: 96-26-4Formula: C3H6O3Molecular weight: 90.08Synonyms: Dihydroxyacetone (USP) | Dihydroxyacetone [USP] | EN300-121747 | FEMA NO. 4033 | HY-Y0335 | EINECS 2...SMILES: C(C(=O)CO)OInChIKey: RXKJFZQQPQGTFL-UHFFFAOYSA-NInChI: InChI=1S/C3H6O3/c4-1-3(6)2-5/h4-5H,1-2H2
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Styrene
Formula: C8H8Molecular weight: 104.15Synonyms: STYRENE (IARC) | STYRENE-ALPHA-13C | Vinyl benzene | Diarex hf 77 | Styrol | HSDB 171 | STYRENE [MI]...SMILES: C=CC1=CC=CC=C1InChIKey: PPBRXRYQALVLMV-UHFFFAOYSA-NInChI: InChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2
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