1-[4-[(4-bromophenyl)methyl]piperazin-1-yl]sulfonylazepane

Systemtic Name: 1-[4-[(4-bromophenyl)methyl]piperazin-1-yl]sulfonylazepane Openeye Name: 1-[4-[(4-bromophenyl)methyl]piperazin-1-yl]sulfonylazepane CAS Name: 1-[[4-[(4-bromophenyl)methyl]-1-piperazinyl]sulfonyl]azepane IUPAC Name: 1-[4-[(4-bromophenyl)methyl]piperazin-1-yl]sulfonylazepane Traditional Name: 1-[4-(4-bromobenzyl)piperazino]sulfonylazepane Formula: C17H26BrN3O2S MolecularWeight: 416.37624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26BrN3O2S/c18-17-7-5-16(6-8-17)15-19-11-13-21(14-12-19)24(22,23)20-9-3-1-2-4-10-20/h5-8H,1-4,9-15H2