1-[2-(2-fluorophenyl)sulfanylethyl]-1,4-diazepane

Systemtic Name: 1-[2-(2-fluorophenyl)sulfanylethyl]-1,4-diazepane Openeye Name: 1-[2-(2-fluorophenyl)sulfanylethyl]-1,4-diazepane CAS Name: 1-[2-[(2-fluorophenyl)thio]ethyl]-1,4-diazepane IUPAC Name: 1-[2-(2-fluorophenyl)sulfanylethyl]-1,4-diazepane Traditional Name: 1-[2-[(2-fluorophenyl)thio]ethyl]-1,4-diazepane Formula: C13H19FN2S MolecularWeight: 254.366763

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)CCSC2=CC=CC=C2F

Isomeric SMILES

C1CNCCN(C1)CCSC2=CC=CC=C2F

InChI

InChI=1S/C13H19FN2S/c14-12-4-1-2-5-13(12)17-11-10-16-8-3-6-15-7-9-16/h1-2,4-5,15H,3,6-11H2