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mevociclib , CAS No.1816989-16-8, Inhibitor of cyclin dependent kinase 7
Basic Description Synonyms BDBM50528812 | N-((1S,3R)-3-((5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl)amino)-1-methylcyclohexyl)-5-(((E)-4-(dimethylamino)but-2-enoyl)amino)pyridine-2-carboxamide | ZB1598 | A930233 | NSC830173 | NSC-830173 | MS-30489 | N-[(1S,3R)-3-[[5-chloro-4-(1H-indo Specifications & Purity Moligand™ Grade Moligand™ Action Type INHIBITOR Mechanism of action Inhibitor of cyclin dependent kinase 7
Associated Targets(Human) Names and Identifiers IUPAC Name N-[(1S,3R)-3-[[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]amino]-1-methylcyclohexyl]-5-[[(E)-4-(dimethylamino)but-2-enoyl]amino]pyridine-2-carboxamide INCHI InChI=1S/C31H35ClN8O2/c1-31(39-29(42)26-13-12-21(17-33-26)36-27(41)11-7-15-40(2)3)14-6-8-20(16-31)37-30-35-19-24(32)28(38-30)23-18-34-25-10-5-4-9-22(23)25/h4-5,7,9-13,17-20,34H,6,8,14-16H2,1-3H3,(H,36,41)(H,39,42)(H,35,37,38)/b11-7+/t20-,31+/m1/s1 InChi Key SCJNYBYSTCRPAO-LXBQGUBHSA-N Canonical SMILES CC1(CCCC(C1)NC2=NC=C(C(=N2)C3=CNC4=CC=CC=C43)Cl)NC(=O)C5=NC=C(C=C5)NC(=O)C=CCN(C)C Isomeric SMILES C[C@@]1(CCC[C@H](C1)NC2=NC=C(C(=N2)C3=CNC4=CC=CC=C43)Cl)NC(=O)C5=NC=C(C=C5)NC(=O)/C=C/CN(C)C Alternate CAS 1816989-16-8 PubChem CID 118426108 MeSH Entry Terms mevociclib;N-((1S,3R)-3-((5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl)amino)-1-methylcyclohexyl)-5-(((E)-4-(dimethylamino)but-2-enoyl)amino)pyridine-2-carboxamide;SY-1365
References 1. Hu S, Marineau JJ, Rajagopal N, Hamman KB, Choi YJ, Schmidt DR, Ke N, Johannessen L, Bradley MJ, Orlando DA et al. . (2019) Discovery and Characterization of SY-1365, a Selective, Covalent Inhibitor of CDK7.. Cancer Res, 79 (13): (3479-3491). [PMID:31064851 ]
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