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E1/E2/E3 Enzyme
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MX69Cas Number: 1005264-47-0Formula: C27H26N2O4S Molecular Weight: 474.57IUPAC Name: 4-[8-[(3,4-dimethylphenyl)sulfamoyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoic acidSMILES: CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=CC=C(C=C5)C(=O)O)CInChIKey: XCBONKHCCRJMNW-UHFFFAOYSA-NInChI: show moreSynonyms: MX69|1005264-47-0|MX-69|4-[8-[(3,4-dimethylphenyl)sulfamoyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzo...
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MX69Cas Number: 1005264-47-0Formula: C27H26N2O4S Molecular Weight: 474.57IUPAC Name: 4-[8-[(3,4-dimethylphenyl)sulfamoyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoic acidSMILES: CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=CC=C(C=C5)C(=O)O)CInChIKey: XCBONKHCCRJMNW-UHFFFAOYSA-NInChI: show moreSynonyms: AC-35792 | STL199512 | MX69 | MX-69 | BS-14153 | BCP19296 | EX-A2460 | C71033 | HY-100892 | 1005264-47-0 | s8403 | 4-...
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NAcM-OPTCas Number: 2089293-61-6Formula: C23H29Cl2N3O Molecular Weight: 434.4IUPAC Name: 1-benzyl-1-(1-butylpiperidin-4-yl)-3-(3,4-dichlorophenyl)ureaSMILES: CCCCN1CCC(CC1)N(CC2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)Cl)ClInChIKey: VPHJABWIKCBGMC-UHFFFAOYSA-NInChI: show moreSynonyms: N-(1-butyl-4-piperidinyl)-N'-(3,4-dichlorophenyl)-N-(phenylmethyl)urea | Urea,N-(1-butyl-4-piperidinyl)-N'-(3,...
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NAcM-OPTCas Number: 2089293-61-6Formula: C23H29Cl2N3O Molecular Weight: 434.4IUPAC Name: 1-benzyl-1-(1-butylpiperidin-4-yl)-3-(3,4-dichlorophenyl)ureaSMILES: CCCCN1CCC(CC1)N(CC2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)Cl)ClInChIKey: VPHJABWIKCBGMC-UHFFFAOYSA-NInChI: show moreSynonyms: N-(1-butyl-4-piperidinyl)-N'-(3,4-dichlorophenyl)-N-(phenylmethyl)urea | Urea,N-(1-butyl-4-piperidinyl)-N'-(3,...
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NSC697923Cas Number: 343351-67-7Formula: C11H9NO5S Molecular Weight: 267.26IUPAC Name: 2-(4-methylphenyl)sulfonyl-5-nitrofuranSMILES: CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O2)[N+](=O)[O-]InChIKey: GAUHIPWCDXOLCZ-UHFFFAOYSA-NInChI: InChI=1S/C11H9NO5S/c1-8-2-4-9(5-3-8)18(15,16)11-7-6-10(17-11)12(13)14/h2-7H,1H3Synonyms: NSC697923|343351-67-7|2-[(4-methylphenyl)sulfonyl]-5-nitrofuran|NSC 697923|NSC-697923|2-(4-methylphenyl)sulfonyl-5-ni...
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NSC232003Cas Number: 1905453-18-0Formula: C6H7N3O3 Molecular Weight: 169.14IUPAC Name: 5-[(E)-N-hydroxy-C-methylcarbonimidoyl]-1H-pyrimidine-2,4-dioneSMILES: CC(=NO)C1=CNC(=O)NC1=OInChIKey: UDHCVAJUUVCYHW-YCRREMRBSA-NInChI: InChI=1S/C6H7N3O3/c1-3(9-12)4-2-7-6(11)8-5(4)10/h2,12H,1H3,(H2,7,8,10,11)/b9-3+
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NVP-CGM097Cas Number: 1313363-54-0Formula: C38H47ClN4O4 Molecular Weight: 659.26IUPAC Name: show moreSMILES: CC(C)OC1=C(C=C2CC(=O)N(C(C2=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)CC5CCC(CC5)N6CCN(C(=O)C6)C)OCInChIKey: CLRSLRWKONPSRQ-CPOWQTMSSA-NInChI: show moreSynonyms: AKOS030526402 | BP-10652 | NSC783015 | NSC-783015 | SCHEMBL2391196 | CCG-270337 | Uridine pyrophosphate a-delta-galac...
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NVP-CGM097Cas Number: 1313363-54-0Formula: C38H47ClN4O4 Molecular Weight: 659.26IUPAC Name: show moreSMILES: CC(C)OC1=C(C=C2CC(=O)N(C(C2=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)CC5CCC(CC5)N6CCN(C(=O)C6)C)OCInChIKey: CLRSLRWKONPSRQ-CPOWQTMSSA-NInChI: show moreSynonyms: NVP-CGM097|1313363-54-0|CGM097|CGM-097|CGM 097|NVP-CGM-097|4UF6MSL0ZH|NVP-CGM097 (CGM-097)|(1S)-1-(4-chlorophenyl)-6-...
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Nutlin-3bCas Number: 675576-97-3Formula: C30H30Cl2N4O4 Molecular Weight: 581.49IUPAC Name: 4-[(4R,5S)-4,5-bis(4-chlorophenyl)-2-(4-methoxy-2-propan-2-yloxyphenyl)-4,5-dihydroimidazole-1-carbonyl]piperazin-2-oneSMILES: CC(C)OC1=C(C=CC(=C1)OC)C2=NC(C(N2C(=O)N3CCNC(=O)C3)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)ClInChIKey: BDUHCSBCVGXTJM-IZLXSDGUSA-NInChI: show moreSynonyms: (+/-)-4-[4,5-Bis(4-chlorophenyl)-2-(2-isopropoxy-4-methoxy-phenyl)-4,5-dihydro-imidazole-1-carbonyl]-piperazin-2-one ...
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PRT 4165Cas Number: 31083-55-3 Compound CID: 207893Formula: C15H9NO2 Molecular Weight: 235.24IUPAC Name: 2-(pyridin-3-ylmethylidene)indene-1,3-dioneSMILES: C1=CC=C2C(=C1)C(=O)C(=CC3=CN=CC=C3)C2=OInChIKey: OMHZFEWYVFWVLI-UHFFFAOYSA-NInChI: InChI=1S/C15H9NO2/c17-14-11-5-1-2-6-12(11)15(18)13(14)8-10-4-3-7-16-9-10/h1-9HSynonyms: 31083-55-3|PRT4165|PRT 4165|1,3-Indandione, 2-(3-pyridylmethylene)-|2-(3-Pyridinylmethylene)-1H-Indene-1,3(2H)-dione|...
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PYR-41Cas Number: 418805-02-4 Compound CID: 5335621Formula: C17H13N3O7 Molecular Weight: 371.3IUPAC Name: ethyl 4-[(4Z)-4-[(5-nitrofuran-2-yl)methylidene]-3,5-dioxopyrazolidin-1-yl]benzoateSMILES: CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)[N+](=O)[O-])C(=O)N2InChIKey: ARGIPZKQJGFSGQ-LCYFTJDESA-NInChI: InChI=1S/C17H13N3O7/c1-2-26-17(23)10-3-5-11(6-4-10)19-16(22)13(15(21)18-19)9-12-7-8-14(27-12)20(24)25/h3-9H,2H2,1H3,(H,18,21)/b13-9-Synonyms: PYR-41|418805-02-4|PYR 41|PYR41|ethyl 4-(4-((5-nitrofuran-2-yl)methylene)-3,5-dioxopyrazolidin-1-yl)benzoate|ethyl 4-...
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RG7388, Tumour suppressor p53/oncoprotein Mdm2 inhibitorCas Number: 1229705-06-9 Compound CID: 53358942Formula: C31H29Cl2F2N3O4 Molecular Weight: 616.48IUPAC Name: show moreSMILES: CC(C)(C)CC1C(C(C(N1)C(=O)NC2=C(C=C(C=C2)C(=O)O)OC)C3=C(C(=CC=C3)Cl)F)(C#N)C4=C(C=C(C=C4)Cl)FInChIKey: TVTXCJFHQKSQQM-LJQIRTBHSA-NInChI: show moreSynonyms: TVTXCJFHQKSQQM-LJQIRTBHSA-N | EN300-26181975 | RO5503781 | BP-25380 | 4-((2R,3S,4R,5S)-3-(3-chloro-2-fluorophenyl)-4-...
