N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-ethyl-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-ethyl-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-ethyl-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N-ethyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C18H28N3O3S+ MolecularWeight: 366.49822

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCS(=O)(=O)C1)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCN([C@H]1CCS(=O)(=O)C1)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C18H27N3O3S/c1-2-21(17-8-13-25(23,24)15-17)18(22)14-19-9-11-20(12-10-19)16-6-4-3-5-7-16/h3-7,17H,2,8-15H2,1H3/p+1/t17-/m0/s1