[(2R)-3-ethyl-1-[[(3S)-thiolan-3-yl]amino]pentan-2-yl]-dimethyl-azanium

Systemtic Name: [(2R)-3-ethyl-1-[[(3S)-thiolan-3-yl]amino]pentan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-2-ethyl-1-[[[(3S)-tetrahydrothiophen-3-yl]amino]methyl]butyl]-dimethyl-ammonium CAS Name: [(2R)-3-ethyl-1-[[(3S)-3-thiolanyl]amino]pentan-2-yl]-dimethylammonium IUPAC Name: [(2R)-3-ethyl-1-[[(3S)-thiolan-3-yl]amino]pentan-2-yl]-dimethylazanium Traditional Name: [(1R)-2-ethyl-1-[[[(3S)-tetrahydrothiophen-3-yl]amino]methyl]butyl]-dimethyl-ammonium Formula: C13H29N2S+ MolecularWeight: 245.44776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC1CCSC1)[NH+](C)C

Isomeric SMILES

CCC(CC)[C@H](CN[C@H]1CCSC1)[NH+](C)C

InChI

InChI=1S/C13H28N2S/c1-5-11(6-2)13(15(3)4)9-14-12-7-8-16-10-12/h11-14H,5-10H2,1-4H3/p+1/t12-,13-/m0/s1