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

Systemtic Name: [butylamino(methylsulfanyl)methylidene]-methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [butylamino(methylsulfanyl)methylene]-methyl-(3-pyridylmethyl)ammonium CAS Name: [butylamino-(methylthio)methylidene]-methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [butylamino(methylsulfanyl)methylidene]-methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [butylamino-(methylthio)methylene]-methyl-(3-pyridylmethyl)ammonium Formula: C13H22N3S+ MolecularWeight: 252.39888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3S/c1-4-5-9-15-13(17-3)16(2)11-12-7-6-8-14-10-12/h6-8,10H,4-5,9,11H2,1-3H3/p+1