5-(3,3-二甲基-1-丁炔-1-基)-3-[(顺式-4-羟基环己基)[(反式-4-甲基环己基)羰基]氨基]-2-噻吩甲酸

pro_cas
1026785-59-0
pro_cdbregno
CCD03973377
pro_formula
C25 H35 N O4 S
pro_molWeight
445.621

basic_info

Product_Name: 5-(3,3-二甲基-1-丁炔-1-基)-3-[(顺式-4-羟基环己基)[(反式-4-甲基环己基)羰基]氨基]-2-噻吩甲酸
CAS: 1026785-59-0
中文同义词: 5-(3,3-二甲基-1-丁炔-1-基)-3-[(顺式-4-羟基环己基)[(反式-4-甲基环己基)羰基]氨基]-2-噻吩甲酸
EnglishSynonyms: 5-(3,3-DIMETHYL-1-BUTYN-1-YL)-3-[(CIS-4-HYDROXYCYCLOHEXYL)[(TRANS-4-METHYLCYCLOHEXYL)CARBONYL]AMINO]-2-THIOPHENECARBOXYLIC ACID ; VX-222 ; VCH222 ; VX-222 (VCH-222, LOMIBUVIR)
pro_mdlNumber: MFCD18089858
pro_acceptors: 5
pro_donors: 2
pro_smile: C[C@H]1CC[C@@H](CC1)C(=O)N(c2cc(sc2C(=O)O)C#CC(C)(C)C)[C@H]3CC[C@H](CC3)O
InChi: InChI=1S/C25H35NO4S/c1-16-5-7-17(8-6-16)23(28)26(18-9-11-19(27)12-10-18)21-15-20(13-14-25(2,3)4)31-22(21)24(29)30/h15-19,27H,5-12H2,1-4H3,(H,29,30)/t16-,17-,18-,19+
InChiKey: InChIKey=WPMJNLCLKAKMLA-UGLKCIBTSA-N

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