N5-(3-methylsulfanylphenyl)pyridin-1-ium-2,5-diamine

Systemtic Name: N5-(3-methylsulfanylphenyl)pyridin-1-ium-2,5-diamine Openeye Name: N5-(3-methylsulfanylphenyl)pyridin-1-ium-2,5-diamine CAS Name: N5-[3-(methylthio)phenyl]pyridin-1-ium-2,5-diamine IUPAC Name: 5-N-(3-methylsulfanylphenyl)pyridin-1-ium-2,5-diamine Traditional Name: (6-aminopyridin-1-ium-3-yl)-[3-(methylthio)phenyl]amine Formula: C12H14N3S+ MolecularWeight: 232.32466

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC2=C[NH+]=C(C=C2)N

Isomeric SMILES

CSC1=CC=CC(=C1)NC2=C[NH+]=C(C=C2)N

InChI

InChI=1S/C12H13N3S/c1-16-11-4-2-3-9(7-11)15-10-5-6-12(13)14-8-10/h2-8,15H,1H3,(H2,13,14)/p+1