[(1R)-2-[(3-azanyl-3-sulfanylidene-propanoyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(3-azanyl-3-sulfanylidene-propanoyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(3-amino-3-thioxo-propanoyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[(3-amino-1-oxo-3-sulfanylidenepropyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(3-amino-3-sulfanylidenepropanoyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1R)-2-[(3-amino-3-thioxo-propanoyl)amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C14H22N3O2S+ MolecularWeight: 296.40838

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CC(=S)N)C1=CC(=CC=C1)OC

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)CC(=S)N)C1=CC(=CC=C1)OC

InChI

InChI=1S/C14H21N3O2S/c1-17(2)12(9-16-14(18)8-13(15)20)10-5-4-6-11(7-10)19-3/h4-7,12H,8-9H2,1-3H3,(H2,15,20)(H,16,18)/p+1/t12-/m0/s1