[(1S)-2-azanyl-1-(4-propoxyphenyl)-2-sulfanylidene-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-azanyl-1-(4-propoxyphenyl)-2-sulfanylidene-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-amino-1-(4-propoxyphenyl)-2-thioxo-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-amino-1-(4-propoxyphenyl)-2-sulfanylideneethyl]-dimethylammonium IUPAC Name: [(1S)-2-amino-1-(4-propoxyphenyl)-2-sulfanylideneethyl]-dimethylazanium Traditional Name: [(1S)-2-amino-1-(4-propoxyphenyl)-2-thioxo-ethyl]-dimethyl-ammonium Formula: C13H21N2OS+ MolecularWeight: 253.38364

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C(=S)N)[NH+](C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@H](C(=S)N)[NH+](C)C

InChI

InChI=1S/C13H20N2OS/c1-4-9-16-11-7-5-10(6-8-11)12(13(14)17)15(2)3/h5-8,12H,4,9H2,1-3H3,(H2,14,17)/p+1/t12-/m0/s1