6-[(3-fluorophenyl)methoxy]-1-phenethyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one

Systemtic Name: 6-[(3-fluorophenyl)methoxy]-1-phenethyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 6-[(3-fluorophenyl)methoxy]-1-phenethyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one CAS Name: 6-[(3-fluorophenyl)methoxy]-4-[1-oxo-3-(2-pyrazinyl)propyl]-1-phenethyl-1,4-diazepan-2-one IUPAC Name: 6-[(3-fluorophenyl)methoxy]-1-phenethyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 6-(3-fluorobenzyl)oxy-1-phenethyl-4-(3-pyrazin-2-ylpropanoyl)-1,4-diazepan-2-one Formula: C27H29FN4O3 MolecularWeight: 476.542563

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1C(=O)CCC2=NC=CN=C2)CCC3=CC=CC=C3)OCC4=CC(=CC=C4)F

Isomeric SMILES

C1C(CN(C(=O)CN1C(=O)CCC2=NC=CN=C2)CCC3=CC=CC=C3)OCC4=CC(=CC=C4)F

InChI

InChI=1S/C27H29FN4O3/c28-23-8-4-7-22(15-23)20-35-25-17-31(14-11-21-5-2-1-3-6-21)27(34)19-32(18-25)26(33)10-9-24-16-29-12-13-30-24/h1-8,12-13,15-16,25H,9-11,14,17-20H2