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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]pyridin-1-ium-2-amine Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]pyridin-1-ium-2-amine CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-pyridin-1-iumamine IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]pyridin-1-ium-2-amine Traditional Name: [(3S)-1,1-diketothiolan-3-yl]-pyridin-1-ium-2-yl-amine Formula: C9H13N2O2S+ MolecularWeight: 213.27672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC2=CC=CC=[NH+]2

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1NC2=CC=CC=[NH+]2

InChI

InChI=1S/C9H12N2O2S/c12-14(13)6-4-8(7-14)11-9-3-1-2-5-10-9/h1-3,5,8H,4,6-7H2,(H,10,11)/p+1/t8-/m0/s1