6-[(3-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(1H-pyrazol-4-ylcarbonyl)-1,4-diazepan-2-one

Systemtic Name: 6-[(3-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(1H-pyrazol-4-ylcarbonyl)-1,4-diazepan-2-one Openeye Name: 6-[(3-fluorophenyl)methoxy]-1-isobutyl-4-(1H-pyrazole-4-carbonyl)-1,4-diazepan-2-one CAS Name: 6-[(3-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-[oxo(1H-pyrazol-4-yl)methyl]-1,4-diazepan-2-one IUPAC Name: 6-[(3-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(1H-pyrazole-4-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-(3-fluorobenzyl)oxy-1-isobutyl-4-(1H-pyrazole-4-carbonyl)-1,4-diazepan-2-one Formula: C20H25FN4O3 MolecularWeight: 388.435903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)C2=CNN=C2)OCC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)C2=CNN=C2)OCC3=CC(=CC=C3)F

InChI

InChI=1S/C20H25FN4O3/c1-14(2)9-24-10-18(28-13-15-4-3-5-17(21)6-15)11-25(12-19(24)26)20(27)16-7-22-23-8-16/h3-8,14,18H,9-13H2,1-2H3,(H,22,23)