methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]azanium

Systemtic Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]azanium Openeye Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxo-2-(prop-2-ynylamino)ethyl]ammonium CAS Name: methyl-[[4-(methylthio)phenyl]methyl]-[2-oxo-2-(prop-2-ynylamino)ethyl]ammonium IUPAC Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxo-2-(prop-2-ynylamino)ethyl]azanium Traditional Name: [2-keto-2-(propargylamino)ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C14H19N2OS+ MolecularWeight: 263.37846

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NCC#C

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NCC#C

InChI

InChI=1S/C14H18N2OS/c1-4-9-15-14(17)11-16(2)10-12-5-7-13(18-3)8-6-12/h1,5-8H,9-11H2,2-3H3,(H,15,17)/p+1