1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-2-(2-phenylphenoxy)ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-2-(2-phenylphenoxy)ethanone Openeye Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-2-(2-phenylphenoxy)ethanone CAS Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-2-(2-phenylphenoxy)ethanone IUPAC Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-2-(2-phenylphenoxy)ethanone Traditional Name: 1-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-2-(2-phenylphenoxy)ethanone Formula: C25H25FN2O4S MolecularWeight: 468.540403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)COC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)COC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C25H25FN2O4S/c26-21-11-13-22(14-12-21)33(30,31)28-16-6-15-27(17-18-28)25(29)19-32-24-10-5-4-9-23(24)20-7-2-1-3-8-20/h1-5,7-14H,6,15-19H2