4-(2-imidazol-1-ylethanoyl)-1-propan-2-yl-6-[[4-(trifluoromethyloxy)phenyl]methoxy]-1,4-diazepan-2-one

Systemtic Name: 4-(2-imidazol-1-ylethanoyl)-1-propan-2-yl-6-[[4-(trifluoromethyloxy)phenyl]methoxy]-1,4-diazepan-2-one Openeye Name: 4-(2-imidazol-1-ylacetyl)-1-isopropyl-6-[[4-(trifluoromethoxy)phenyl]methoxy]-1,4-diazepan-2-one CAS Name: 4-[2-(1-imidazolyl)-1-oxoethyl]-1-propan-2-yl-6-[[4-(trifluoromethoxy)phenyl]methoxy]-1,4-diazepan-2-one IUPAC Name: 4-(2-imidazol-1-ylacetyl)-1-propan-2-yl-6-[[4-(trifluoromethoxy)phenyl]methoxy]-1,4-diazepan-2-one Traditional Name: 4-(2-imidazol-1-ylacetyl)-1-isopropyl-6-[4-(trifluoromethoxy)benzyl]oxy-1,4-diazepan-2-one Formula: C21H25F3N4O4 MolecularWeight: 454.44281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CN(CC1=O)C(=O)CN2C=CN=C2)OCC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(C)N1CC(CN(CC1=O)C(=O)CN2C=CN=C2)OCC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H25F3N4O4/c1-15(2)28-10-18(31-13-16-3-5-17(6-4-16)32-21(22,23)24)9-27(12-20(28)30)19(29)11-26-8-7-25-14-26/h3-8,14-15,18H,9-13H2,1-2H3