1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]sulfonylazepane

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]sulfonylazepane Openeye Name: 1-[4-(p-tolylsulfonyl)piperazin-1-yl]sulfonylazepane CAS Name: 1-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]sulfonyl]azepane IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]sulfonylazepane Traditional Name: 1-(4-tosylpiperazino)sulfonylazepane Formula: C17H27N3O4S2 MolecularWeight: 401.54398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C17H27N3O4S2/c1-16-6-8-17(9-7-16)25(21,22)18-12-14-20(15-13-18)26(23,24)19-10-4-2-3-5-11-19/h6-9H,2-5,10-15H2,1H3