4-(2-methylpyrazol-3-yl)carbonyl-1-propan-2-yl-6-[[4-(trifluoromethyloxy)phenyl]methoxy]-1,4-diazepan-2-one

Systemtic Name: 4-(2-methylpyrazol-3-yl)carbonyl-1-propan-2-yl-6-[[4-(trifluoromethyloxy)phenyl]methoxy]-1,4-diazepan-2-one Openeye Name: 1-isopropyl-4-(2-methylpyrazole-3-carbonyl)-6-[[4-(trifluoromethoxy)phenyl]methoxy]-1,4-diazepan-2-one CAS Name: 4-[(2-methyl-3-pyrazolyl)-oxomethyl]-1-propan-2-yl-6-[[4-(trifluoromethoxy)phenyl]methoxy]-1,4-diazepan-2-one IUPAC Name: 4-(2-methylpyrazole-3-carbonyl)-1-propan-2-yl-6-[[4-(trifluoromethoxy)phenyl]methoxy]-1,4-diazepan-2-one Traditional Name: 1-isopropyl-4-(2-methylpyrazole-3-carbonyl)-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)C2=CC=NN2C)OCC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(C)N1CC(CN(CC1=O)C(=O)C2=CC=NN2C)OCC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H25F3N4O4/c1-14(2)28-11-17(31-13-15-4-6-16(7-5-15)32-21(22,23)24)10-27(12-19(28)29)20(30)18-8-9-25-26(18)3/h4-9,14,17H,10-13H2,1-3H3