6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(1H-pyrazol-5-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(1H-pyrazol-5-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-[(2-fluorophenyl)methoxy]-1-isobutyl-4-(1H-pyrazol-5-ylmethyl)-1,4-diazepan-2-one CAS Name: 6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(1H-pyrazol-5-ylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-[(2-fluorophenyl)methoxy]-1-(2-methylpropyl)-4-(1H-pyrazol-5-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-(2-fluorobenzyl)oxy-1-isobutyl-4-(1H-pyrazol-5-ylmethyl)-1,4-diazepan-2-one Formula: C20H27FN4O2 MolecularWeight: 374.452383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)CC2=CC=NN2)OCC3=CC=CC=C3F

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)CC2=CC=NN2)OCC3=CC=CC=C3F

InChI

InChI=1S/C20H27FN4O2/c1-15(2)9-25-12-18(27-14-16-5-3-4-6-19(16)21)11-24(13-20(25)26)10-17-7-8-22-23-17/h3-8,15,18H,9-14H2,1-2H3,(H,22,23)