1-[4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-4-ium-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-4-ium-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[4-[(3S)-1,1-dioxo-3-thiolanyl]-1-piperazin-4-iumyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[4-[(3S)-1,1-diketothiolan-3-yl]piperazin-4-ium-1-yl]-3-phenyl-propan-1-one Formula: C17H25N2O3S+ MolecularWeight: 337.457

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1[NH+]2CCN(CC2)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1[NH+]2CCN(CC2)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C17H24N2O3S/c20-17(7-6-15-4-2-1-3-5-15)19-11-9-18(10-12-19)16-8-13-23(21,22)14-16/h1-5,16H,6-14H2/p+1/t16-/m0/s1