[(1R)-1-(3-methoxyphenyl)-2-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(3-methoxyphenyl)-2-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(3-methoxyphenyl)-2-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(3-methoxyphenyl)-2-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(3-methoxyphenyl)-2-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]-dimethylazanium Traditional Name: [(1R)-1-(3-methoxyphenyl)-2-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)ethyl]-dimethyl-ammonium Formula: C14H21N4OS+ MolecularWeight: 293.40774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1CC(C2=CC(=CC=C2)OC)[NH+](C)C

Isomeric SMILES

CC1=NNC(=S)N1C[C@@H](C2=CC(=CC=C2)OC)[NH+](C)C

InChI

InChI=1S/C14H20N4OS/c1-10-15-16-14(20)18(10)9-13(17(2)3)11-6-5-7-12(8-11)19-4/h5-8,13H,9H2,1-4H3,(H,16,20)/p+1/t13-/m0/s1