1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]sulfonylazepane

Systemtic Name: 1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]sulfonylazepane Openeye Name: 1-[4-(3-pyridylmethyl)piperazin-1-yl]sulfonylazepane CAS Name: 1-[[4-(3-pyridinylmethyl)-1-piperazinyl]sulfonyl]azepane IUPAC Name: 1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]sulfonylazepane Traditional Name: 1-[4-(3-pyridylmethyl)piperazino]sulfonylazepane Formula: C16H26N4O2S MolecularWeight: 338.46824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N4O2S/c21-23(22,19-8-3-1-2-4-9-19)20-12-10-18(11-13-20)15-16-6-5-7-17-14-16/h5-7,14H,1-4,8-13,15H2