1-[4-[4-(phenylmethyl)piperazin-1-yl]sulfonylphenyl]piperidin-2-one

Systemtic Name: 1-[4-[4-(phenylmethyl)piperazin-1-yl]sulfonylphenyl]piperidin-2-one Openeye Name: 1-[4-(4-benzylpiperazin-1-yl)sulfonylphenyl]piperidin-2-one CAS Name: 1-[4-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]phenyl]-2-piperidinone IUPAC Name: 1-[4-(4-benzylpiperazin-1-yl)sulfonylphenyl]piperidin-2-one Traditional Name: 1-[4-(4-benzylpiperazino)sulfonylphenyl]-2-piperidone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O3S/c26-22-8-4-5-13-25(22)20-9-11-21(12-10-20)29(27,28)24-16-14-23(15-17-24)18-19-6-2-1-3-7-19/h1-3,6-7,9-12H,4-5,8,13-18H2