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

Systemtic Name: methyl-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]azanium Openeye Name: methyl-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]-[2-oxo-2-(prop-2-ynylamino)ethyl]ammonium CAS Name: methyl-[2-[2-(methylthio)anilino]-2-oxoethyl]-[2-oxo-2-(prop-2-ynylamino)ethyl]ammonium IUPAC Name: methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]-[2-oxo-2-(prop-2-ynylamino)ethyl]azanium Traditional Name: [2-keto-2-[2-(methylthio)anilino]ethyl]-[2-keto-2-(propargylamino)ethyl]-methyl-ammonium Formula: C15H20N3O2S+ MolecularWeight: 306.4032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O2S/c1-4-9-16-14(19)10-18(2)11-15(20)17-12-7-5-6-8-13(12)21-3/h1,5-8H,9-11H2,2-3H3,(H,16,19)(H,17,20)/p+1