4-[2-[(3-fluorophenyl)methoxy]ethyl]-1-(phenylsulfonyl)-1,4-diazepan-5-one

Systemtic Name: 4-[2-[(3-fluorophenyl)methoxy]ethyl]-1-(phenylsulfonyl)-1,4-diazepan-5-one Openeye Name: 1-(benzenesulfonyl)-4-[2-[(3-fluorophenyl)methoxy]ethyl]-1,4-diazepan-5-one CAS Name: 1-(benzenesulfonyl)-4-[2-[(3-fluorophenyl)methoxy]ethyl]-1,4-diazepan-5-one IUPAC Name: 1-(benzenesulfonyl)-4-[2-[(3-fluorophenyl)methoxy]ethyl]-1,4-diazepan-5-one Traditional Name: 1-besyl-4-[2-(3-fluorobenzyl)oxyethyl]-1,4-diazepan-5-one Formula: C20H23FN2O4S MolecularWeight: 406.471023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CCOCC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1=O)CCOCC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23FN2O4S/c21-18-6-4-5-17(15-18)16-27-14-13-22-11-12-23(10-9-20(22)24)28(25,26)19-7-2-1-3-8-19/h1-8,15H,9-14,16H2