4-[(2-fluorophenyl)methyl]-1-(2-phenylsulfanylethanoyl)-1,4-diazepan-5-one

Systemtic Name: 4-[(2-fluorophenyl)methyl]-1-(2-phenylsulfanylethanoyl)-1,4-diazepan-5-one Openeye Name: 4-[(2-fluorophenyl)methyl]-1-(2-phenylsulfanylacetyl)-1,4-diazepan-5-one CAS Name: 4-[(2-fluorophenyl)methyl]-1-[1-oxo-2-(phenylthio)ethyl]-1,4-diazepan-5-one IUPAC Name: 4-[(2-fluorophenyl)methyl]-1-(2-phenylsulfanylacetyl)-1,4-diazepan-5-one Traditional Name: 4-(2-fluorobenzyl)-1-[2-(phenylthio)acetyl]-1,4-diazepan-5-one Formula: C20H21FN2O2S MolecularWeight: 372.456343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CC2=CC=CC=C2F)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1=O)CC2=CC=CC=C2F)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C20H21FN2O2S/c21-18-9-5-4-6-16(18)14-23-13-12-22(11-10-19(23)24)20(25)15-26-17-7-2-1-3-8-17/h1-9H,10-15H2