[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]azanium

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl]azanium Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl]-methyl-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]ammonium CAS Name: [2-(cyclopropylamino)-2-oxoethyl]-methyl-[2-oxo-2-[2-(phenylthio)ethylamino]ethyl]ammonium IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl]-methyl-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]azanium Traditional Name: [2-(cyclopropylamino)-2-keto-ethyl]-[2-keto-2-[2-(phenylthio)ethylamino]ethyl]-methyl-ammonium Formula: C16H24N3O2S+ MolecularWeight: 322.44566

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)NCCSC1=CC=CC=C1)CC(=O)NC2CC2

Isomeric SMILES

C[NH+](CC(=O)NCCSC1=CC=CC=C1)CC(=O)NC2CC2

InChI

InChI=1S/C16H23N3O2S/c1-19(12-16(21)18-13-7-8-13)11-15(20)17-9-10-22-14-5-3-2-4-6-14/h2-6,13H,7-12H2,1H3,(H,17,20)(H,18,21)/p+1