4-[2-(4-fluoranylphenoxy)ethyl]-1-(2-phenylsulfanylethanoyl)-1,4-diazepan-5-one

Systemtic Name: 4-[2-(4-fluoranylphenoxy)ethyl]-1-(2-phenylsulfanylethanoyl)-1,4-diazepan-5-one Openeye Name: 4-[2-(4-fluorophenoxy)ethyl]-1-(2-phenylsulfanylacetyl)-1,4-diazepan-5-one CAS Name: 4-[2-(4-fluorophenoxy)ethyl]-1-[1-oxo-2-(phenylthio)ethyl]-1,4-diazepan-5-one IUPAC Name: 4-[2-(4-fluorophenoxy)ethyl]-1-(2-phenylsulfanylacetyl)-1,4-diazepan-5-one Traditional Name: 4-[2-(4-fluorophenoxy)ethyl]-1-[2-(phenylthio)acetyl]-1,4-diazepan-5-one Formula: C21H23FN2O3S MolecularWeight: 402.482323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CCOC2=CC=C(C=C2)F)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1=O)CCOC2=CC=C(C=C2)F)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C21H23FN2O3S/c22-17-6-8-18(9-7-17)27-15-14-24-13-12-23(11-10-20(24)25)21(26)16-28-19-4-2-1-3-5-19/h1-9H,10-16H2