Basic Information |
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Product Name: | ETHANOL, 2-[[(3AR,4S,6R,6AS)-6-[7-[[(1R,2S)-2-(3,4-DIFLUOROPHENYL)CYCLOPROPYL]AMINO]-5-(PROPYLTHIO)-3H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDIN-3-YL]TETRAHYDRO-2,2-DIMETHYL-4H-CYCLOPENTA-1,3-DIOXOL-4-YL]OXY]- |
CAS: | 274693-26-4 |
English Synonyms: | ETHANOL, 2-[[(3AR,4S,6R,6AS)-6-[7-[[(1R,2S)-2-(3,4-DIFLUOROPHENYL)CYCLOPROPYL]AMINO]-5-(PROPYLTHIO)-3H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDIN-3-YL]TETRAHYDRO-2,2-DIMETHYL-4H-CYCLOPENTA-1,3-DIOXOL-4-YL]OXY]- |
MDL Number.: | MFCD23160137 |
H bond acceptor: | 10 |
H bond donor: | 2 |
Smile: | CCCSc1nc(c2c(n1)n(nn2)[C@@H]3C[C@@H]([C@@H]4[C@H]3OC(O4)(C)C)OCCO)N[C@@H]5C[C@H]5c6ccc(c(c6)F)F |
InChi: | InChI=1S/C26H32F2N6O4S/c1-4-9-39-25-30-23(29-17-11-14(17)13-5-6-15(27)16(28)10-13)20-24(31-25)34(33-32-20)18-12-19(36-8-7-35)22-21(18)37-26(2,3)38-22/h5-6,10,14,17-19,21-22,35H,4,7-9,11-12H2,1-3H3,(H,29,30,31)/t14-,17+,18+,19-,21-,22+/m0/s1 |
InChiKey: | InChIKey=WLEOHEIRUFTYCF-FYEBJQQMSA-N |
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