[1-(furan-2-ylcarbonyl)piperidin-3-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [1-(furan-2-ylcarbonyl)piperidin-3-yl]-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-[1-(furan-2-carbonyl)-3-piperidyl]methanone CAS Name: [1-[2-furanyl(oxo)methyl]-3-piperidinyl]-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-[1-(furan-2-carbonyl)piperidin-3-yl]methanone Traditional Name: (4-benzylsulfonylpiperazino)-[1-(2-furoyl)-3-piperidyl]methanone Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CO2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CO2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O5S/c26-21(19-8-4-10-24(16-19)22(27)20-9-5-15-30-20)23-11-13-25(14-12-23)31(28,29)17-18-6-2-1-3-7-18/h1-3,5-7,9,15,19H,4,8,10-14,16-17H2