[(2R)-2-cyanopropyl]-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [(2R)-2-cyanopropyl]-methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [(2R)-2-cyanopropyl]-methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]ammonium CAS Name: [(2R)-2-cyanopropyl]-methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]ammonium IUPAC Name: [(2R)-2-cyanopropyl]-methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]azanium Traditional Name: [(2R)-2-cyanopropyl]-[2-keto-2-[2-(methylthio)anilino]ethyl]-methyl-ammonium Formula: C14H20N3OS+ MolecularWeight: 278.3931

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](C)CC(=O)NC1=CC=CC=C1SC)C#N

Isomeric SMILES

C[C@H](C[NH+](C)CC(=O)NC1=CC=CC=C1SC)C#N

InChI

InChI=1S/C14H19N3OS/c1-11(8-15)9-17(2)10-14(18)16-12-6-4-5-7-13(12)19-3/h4-7,11H,9-10H2,1-3H3,(H,16,18)/p+1/t11-/m0/s1