(2S)-2-ethyl-1-methyl-4-(thian-4-yl)piperazin-1-ium

Systemtic Name: (2S)-2-ethyl-1-methyl-4-(thian-4-yl)piperazin-1-ium Openeye Name: (2S)-2-ethyl-1-methyl-4-tetrahydrothiopyran-4-yl-piperazin-1-ium CAS Name: (2S)-2-ethyl-1-methyl-4-(4-thianyl)piperazin-1-ium IUPAC Name: (2S)-2-ethyl-1-methyl-4-(thian-4-yl)piperazin-1-ium Traditional Name: (2S)-2-ethyl-1-methyl-4-tetrahydrothiopyran-4-yl-piperazin-1-ium Formula: C12H25N2S+ MolecularWeight: 229.4053

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC[NH+]1C)C2CCSCC2

Isomeric SMILES

CC[C@H]1CN(CC[NH+]1C)C2CCSCC2

InChI

InChI=1S/C12H24N2S/c1-3-11-10-14(7-6-13(11)2)12-4-8-15-9-5-12/h11-12H,3-10H2,1-2H3/p+1/t11-/m0/s1