Molecular Structure:
CCD No.:CCD03973377
VX-222
CAS No.:
1026785-59-0
Formula:C25 H35 N O4 S
MolWeight:445.621
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| Product Name： | VX-222 |
| CAS： | 1026785-59-0 |
| English Synonyms： | VCH222 ; VX-222 ; 5-(3,3-DIMETHYL-1-BUTYN-1-YL)-3-[(CIS-4-HYDROXYCYCLOHEXYL)[(TRANS-4-METHYLCYCLOHEXYL)CARBONYL]AMINO]-2-THIOPHENECARBOXYLIC ACID ; VX-222 (VCH-222, LOMIBUVIR) |
| MDL Number.： | MFCD18089858 |
| H bond acceptor： | 5 |
| H bond donor： | 2 |
| 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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