methyl-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium

Systemtic Name: methyl-[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium Openeye Name: [2-(2-allylsulfanylanilino)-2-oxo-ethyl]-methyl-[2-oxo-2-(propylamino)ethyl]ammonium CAS Name: methyl-[2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl]-[2-oxo-2-(propylamino)ethyl]ammonium IUPAC Name: methyl-[2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl]-[2-oxo-2-(propylamino)ethyl]azanium Traditional Name: [2-[2-(allylthio)anilino]-2-keto-ethyl]-[2-keto-2-(propylamino)ethyl]-methyl-ammonium Formula: C17H26N3O2S+ MolecularWeight: 336.47224

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CC(=O)NC1=CC=CC=C1SCC=C

Isomeric SMILES

CCCNC(=O)C[NH+](C)CC(=O)NC1=CC=CC=C1SCC=C

InChI

InChI=1S/C17H25N3O2S/c1-4-10-18-16(21)12-20(3)13-17(22)19-14-8-6-7-9-15(14)23-11-5-2/h5-9H,2,4,10-13H2,1,3H3,(H,18,21)(H,19,22)/p+1