[4-(furan-2-ylcarbonyl)piperazin-1-yl]-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]methanone

Systemtic Name: [4-(furan-2-ylcarbonyl)piperazin-1-yl]-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]methanone Openeye Name: [(3S)-1-(benzenesulfonyl)-3-piperidyl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone CAS Name: [(3S)-1-(benzenesulfonyl)-3-piperidinyl]-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]methanone IUPAC Name: [(3S)-1-(benzenesulfonyl)piperidin-3-yl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone Traditional Name: [(3S)-1-besyl-3-piperidyl]-[4-(2-furoyl)piperazino]methanone Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C21H25N3O5S/c25-20(22-11-13-23(14-12-22)21(26)19-9-5-15-29-19)17-6-4-10-24(16-17)30(27,28)18-7-2-1-3-8-18/h1-3,5,7-9,15,17H,4,6,10-14,16H2/t17-/m0/s1