1-[4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]piperazin-1-yl]sulfonylazepane

Systemtic Name: 1-[4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]piperazin-1-yl]sulfonylazepane Openeye Name: 1-[4-[(4-bromo-2-fluoro-phenyl)methyl]piperazin-1-yl]sulfonylazepane CAS Name: 1-[[4-[(4-bromo-2-fluorophenyl)methyl]-1-piperazinyl]sulfonyl]azepane IUPAC Name: 1-[4-[(4-bromo-2-fluorophenyl)methyl]piperazin-1-yl]sulfonylazepane Traditional Name: 1-[4-(4-bromo-2-fluoro-benzyl)piperazino]sulfonylazepane Formula: C17H25BrFN3O2S MolecularWeight: 434.366703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H25BrFN3O2S/c18-16-6-5-15(17(19)13-16)14-20-9-11-22(12-10-20)25(23,24)21-7-3-1-2-4-8-21/h5-6,13H,1-4,7-12,14H2