[4-(furan-2-ylcarbonyl)piperazin-1-yl]-[(3S)-1-(phenylmethyl)sulfonylpiperidin-3-yl]methanone

Systemtic Name: [4-(furan-2-ylcarbonyl)piperazin-1-yl]-[(3S)-1-(phenylmethyl)sulfonylpiperidin-3-yl]methanone Openeye Name: [(3S)-1-benzylsulfonyl-3-piperidyl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone CAS Name: [4-[2-furanyl(oxo)methyl]-1-piperazinyl]-[(3S)-1-(phenylmethyl)sulfonyl-3-piperidinyl]methanone IUPAC Name: [(3S)-1-benzylsulfonylpiperidin-3-yl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone Traditional Name: [(3S)-1-benzylsulfonyl-3-piperidyl]-[4-(2-furoyl)piperazino]methanone Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)CC2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H27N3O5S/c26-21(23-11-13-24(14-12-23)22(27)20-9-5-15-30-20)19-8-4-10-25(16-19)31(28,29)17-18-6-2-1-3-7-18/h1-3,5-7,9,15,19H,4,8,10-14,16-17H2/t19-/m0/s1