[(2-methoxyethylamino)-methylsulfanyl-methylidene]-methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [(2-methoxyethylamino)-methylsulfanyl-methylidene]-methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [(2-methoxyethylamino)-methylsulfanyl-methylene]-methyl-(3-pyridylmethyl)ammonium CAS Name: [(2-methoxyethylamino)-(methylthio)methylidene]-methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [(2-methoxyethylamino)-methylsulfanylmethylidene]-methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [(2-methoxyethylamino)-(methylthio)methylene]-methyl-(3-pyridylmethyl)ammonium Formula: C12H20N3OS+ MolecularWeight: 254.3717

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C(NCCOC)SC)CC1=CN=CC=C1

Isomeric SMILES

C[N+](=C(NCCOC)SC)CC1=CN=CC=C1

InChI

InChI=1S/C12H19N3OS/c1-15(10-11-5-4-6-13-9-11)12(17-3)14-7-8-16-2/h4-6,9H,7-8,10H2,1-3H3/p+1