1-benzothiophen-2-yl-[4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-4-ium-1-yl]methanone

Systemtic Name: 1-benzothiophen-2-yl-[4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-4-ium-1-yl]methanone Openeye Name: benzothiophen-2-yl-[4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-yl]methanone CAS Name: 1-benzothiophen-2-yl-[4-[(3S)-1,1-dioxo-3-thiolanyl]-1-piperazin-4-iumyl]methanone IUPAC Name: 1-benzothiophen-2-yl-[4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-yl]methanone Traditional Name: benzothiophen-2-yl-[4-[(3S)-1,1-diketothiolan-3-yl]piperazin-4-ium-1-yl]methanone Formula: C17H21N2O3S2+ MolecularWeight: 365.49024

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1[NH+]2CCN(CC2)C(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1[NH+]2CCN(CC2)C(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C17H20N2O3S2/c20-17(16-11-13-3-1-2-4-15(13)23-16)19-8-6-18(7-9-19)14-5-10-24(21,22)12-14/h1-4,11,14H,5-10,12H2/p+1/t14-/m0/s1