3-[(2S)-1-[(4-methylsulfanylphenyl)methyl]piperidin-1-ium-2-yl]pyridine

Systemtic Name: 3-[(2S)-1-[(4-methylsulfanylphenyl)methyl]piperidin-1-ium-2-yl]pyridine Openeye Name: 3-[(2S)-1-[(4-methylsulfanylphenyl)methyl]piperidin-1-ium-2-yl]pyridine CAS Name: 3-[(2S)-1-[[4-(methylthio)phenyl]methyl]-2-piperidin-1-iumyl]pyridine IUPAC Name: 3-[(2S)-1-[(4-methylsulfanylphenyl)methyl]piperidin-1-ium-2-yl]pyridine Traditional Name: 3-[(2S)-1-[4-(methylthio)benzyl]piperidin-1-ium-2-yl]pyridine Formula: C18H23N2S+ MolecularWeight: 299.45362

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[NH+]2CCCCC2C3=CN=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)C[NH+]2CCCC[C@H]2C3=CN=CC=C3

InChI

InChI=1S/C18H22N2S/c1-21-17-9-7-15(8-10-17)14-20-12-3-2-6-18(20)16-5-4-11-19-13-16/h4-5,7-11,13,18H,2-3,6,12,14H2,1H3/p+1/t18-/m0/s1