6-[(4-fluorophenyl)methoxy]-1-propan-2-yl-4-(4-pyrazol-1-ylphenyl)carbonyl-1,4-diazepan-2-one

Systemtic Name: 6-[(4-fluorophenyl)methoxy]-1-propan-2-yl-4-(4-pyrazol-1-ylphenyl)carbonyl-1,4-diazepan-2-one Openeye Name: 6-[(4-fluorophenyl)methoxy]-1-isopropyl-4-(4-pyrazol-1-ylbenzoyl)-1,4-diazepan-2-one CAS Name: 6-[(4-fluorophenyl)methoxy]-4-[oxo-[4-(1-pyrazolyl)phenyl]methyl]-1-propan-2-yl-1,4-diazepan-2-one IUPAC Name: 6-[(4-fluorophenyl)methoxy]-1-propan-2-yl-4-(4-pyrazol-1-ylbenzoyl)-1,4-diazepan-2-one Traditional Name: 6-(4-fluorobenzyl)oxy-1-isopropyl-4-(4-pyrazol-1-ylbenzoyl)-1,4-diazepan-2-one Formula: C25H27FN4O3 MolecularWeight: 450.505283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CN(CC1=O)C(=O)C2=CC=C(C=C2)N3C=CC=N3)OCC4=CC=C(C=C4)F

Isomeric SMILES

CC(C)N1CC(CN(CC1=O)C(=O)C2=CC=C(C=C2)N3C=CC=N3)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN4O3/c1-18(2)29-15-23(33-17-19-4-8-21(26)9-5-19)14-28(16-24(29)31)25(32)20-6-10-22(11-7-20)30-13-3-12-27-30/h3-13,18,23H,14-17H2,1-2H3