2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3H-isoindol-2-ium-1-amine

Systemtic Name: 2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3H-isoindol-2-ium-1-amine Openeye Name: 2-[(3S)-1,1-dioxothiolan-3-yl]-3H-isoindol-2-ium-1-amine CAS Name: 2-[(3S)-1,1-dioxo-3-thiolanyl]-3H-isoindol-2-ium-1-amine IUPAC Name: 2-[(3S)-1,1-dioxothiolan-3-yl]-3H-isoindol-2-ium-1-amine Traditional Name: [2-[(3S)-1,1-diketothiolan-3-yl]-3H-isoindol-2-ium-1-yl]amine Formula: C12H15N2O2S+ MolecularWeight: 251.3247

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1[N+]2=C(C3=CC=CC=C3C2)N

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1[N+]2=C(C3=CC=CC=C3C2)N

InChI

InChI=1S/C12H14N2O2S/c13-12-11-4-2-1-3-9(11)7-14(12)10-5-6-17(15,16)8-10/h1-4,10,13H,5-8H2/p+1/t10-/m0/s1