6-[(3-fluorophenyl)methoxy]-4-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(2-methylpropyl)-1,4-diazepan-2-one

Systemtic Name: 6-[(3-fluorophenyl)methoxy]-4-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(2-methylpropyl)-1,4-diazepan-2-one Openeye Name: 6-[(3-fluorophenyl)methoxy]-1-isobutyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-1,4-diazepan-2-one CAS Name: 6-[(3-fluorophenyl)methoxy]-4-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(2-methylpropyl)-1,4-diazepan-2-one IUPAC Name: 6-[(3-fluorophenyl)methoxy]-4-[(5-methyl-1H-imidazol-4-yl)methyl]-1-(2-methylpropyl)-1,4-diazepan-2-one Traditional Name: 6-(3-fluorobenzyl)oxy-1-isobutyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-1,4-diazepan-2-one Formula: C21H29FN4O2 MolecularWeight: 388.478963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CN2CC(CN(C(=O)C2)CC(C)C)OCC3=CC(=CC=C3)F

Isomeric SMILES

CC1=C(N=CN1)CN2CC(CN(C(=O)C2)CC(C)C)OCC3=CC(=CC=C3)F

InChI

InChI=1S/C21H29FN4O2/c1-15(2)8-26-10-19(28-13-17-5-4-6-18(22)7-17)9-25(12-21(26)27)11-20-16(3)23-14-24-20/h4-7,14-15,19H,8-13H2,1-3H3,(H,23,24)