5X4
~{N}-[7-methyl-1-[(3~{R})-1-propanoylazepan-3-yl]benzimidazol-2-yl]-3-(trifluoromethyl)benzamide
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as a non-polymer is covalently linked to polymer or other heterogen groups 2 entries
Chemical Component Summary | |
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Name | ~{N}-[7-methyl-1-[(3~{R})-1-propanoylazepan-3-yl]benzimidazol-2-yl]-3-(trifluoromethyl)benzamide |
Identifiers | ~{N}-[7-methyl-1-[(3~{R})-1-propanoylazepan-3-yl]benzimidazol-2-yl]-3-(trifluoromethyl)benzamide |
Formula | C25 H27 F3 N4 O2 |
Molecular Weight | 472.503 |
Type | NON-POLYMER |
Isomeric SMILES | CCC(=O)N1CCCC[C@H](C1)n2c3c(cccc3nc2NC(=O)c4cccc(c4)C(F)(F)F)C |
InChI | InChI=1S/C25H27F3N4O2/c1-3-21(33)31-13-5-4-11-19(15-31)32-22-16(2)8-6-12-20(22)29-24(32)30-23(34)17-9-7-10-18(14-17)25(26,27)28/h6-10,12,14,19H,3-5,11,13,15H2,1-2H3,(H,29,30,34)/t19-/m1/s1 |
InChIKey | DFNLNAPTJYVZSV-LJQANCHMSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 61 |
Chiral Atom Count | 1 |
Bond Count | 64 |
Aromatic Bond Count | 16 |
Related Resource References
Resource Name | Reference |
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PubChem | 137348410 |