4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-piperazin-4-ium-1-carbothioamide Openeye Name: N-cyclopropyl-4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-carbothioamide CAS Name: N-cyclopropyl-4-[(3S)-1,1-dioxo-3-thiolanyl]-1-piperazin-4-iumcarbothioamide IUPAC Name: N-cyclopropyl-4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-4-ium-1-carbothioamide Traditional Name: N-cyclopropyl-4-[(3S)-1,1-diketothiolan-3-yl]piperazin-4-ium-1-carbothioamide Formula: C12H22N3O2S2+ MolecularWeight: 304.45198

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N2CC[NH+](CC2)C3CCS(=O)(=O)C3

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1[NH+]2CCN(CC2)C(=S)NC3CC3

InChI

InChI=1S/C12H21N3O2S2/c16-19(17)8-3-11(9-19)14-4-6-15(7-5-14)12(18)13-10-1-2-10/h10-11H,1-9H2,(H,13,18)/p+1/t11-/m0/s1