普来曲塞

pro_cas
153537-73-6 ;153538-08-0
pro_cdbregno
CCD00821082
pro_formula
C26 H25 F N8 O4
pro_molWeight
532.534

basic_info

Product_Name: 普来曲塞
CAS: 153537-73-6 ;153538-08-0
中文同义词: (2S)-2-((4-(((2,7-二甲基-4-氧代-1,4-二氢喹唑啉-6-基)甲基)(丙-2-炔基)氨基)-2-氟苯甲酰)氨基)-4-(1H-四唑-5-基)丁酸 ; 普来曲塞
EnglishSynonyms: (2S)-2-[(4-([(2,7-DIMETHYL-4-OXO-1,4-DIHYDROQUINAZOLIN-6-YL)METHYL](PROP-2-YN-1-YL)AMINO)-2-FLUOROPHENYL)FORMAMIDO]-4-(1H-1,2,3,4-TETRAZOL-5-YL)BUTANOIC ACID ; PLEVITREXED
pro_mdlNumber: MFCD09837719
pro_acceptors: 12
pro_donors: 4
pro_smile: Cc1cc2c(cc1CN(CC#C)c3ccc(c(c3)F)C(=O)N[C@@H](CCc4[nH]nnn4)C(=O)O)c(=O)nc([nH]2)C
InChi: InChI=1S/C26H25FN8O4/c1-4-9-35(13-16-11-19-22(10-14(16)2)28-15(3)29-25(19)37)17-5-6-18(20(27)12-17)24(36)30-21(26(38)39)7-8-23-31-33-34-32-23/h1,5-6,10-12,21H,7-9,13H2,2-3H3,(H,30,36)(H,38,39)(H,28,29,37)(H,31,32,33,34)/t21-/m0/s1
InChiKey: InChIKey=IEJSCSAMMLUINT-NRFANRHFSA-N

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