6-[(3-fluorophenyl)methoxy]-4-(2-methylpyrazol-3-yl)carbonyl-1-phenethyl-1,4-diazepan-2-one

Systemtic Name: 6-[(3-fluorophenyl)methoxy]-4-(2-methylpyrazol-3-yl)carbonyl-1-phenethyl-1,4-diazepan-2-one Openeye Name: 6-[(3-fluorophenyl)methoxy]-4-(2-methylpyrazole-3-carbonyl)-1-phenethyl-1,4-diazepan-2-one CAS Name: 6-[(3-fluorophenyl)methoxy]-4-[(2-methyl-3-pyrazolyl)-oxomethyl]-1-phenethyl-1,4-diazepan-2-one IUPAC Name: 6-[(3-fluorophenyl)methoxy]-4-(2-methylpyrazole-3-carbonyl)-1-phenethyl-1,4-diazepan-2-one Traditional Name: 6-(3-fluorobenzyl)oxy-4-(2-methylpyrazole-3-carbonyl)-1-phenethyl-1,4-diazepan-2-one Formula: C25H27FN4O3 MolecularWeight: 450.505283

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)N2CC(CN(C(=O)C2)CCC3=CC=CC=C3)OCC4=CC(=CC=C4)F

Isomeric SMILES

CN1C(=CC=N1)C(=O)N2CC(CN(C(=O)C2)CCC3=CC=CC=C3)OCC4=CC(=CC=C4)F

InChI

InChI=1S/C25H27FN4O3/c1-28-23(10-12-27-28)25(32)30-16-22(33-18-20-8-5-9-21(26)14-20)15-29(24(31)17-30)13-11-19-6-3-2-4-7-19/h2-10,12,14,22H,11,13,15-18H2,1H3