2-[(1-methylpiperidin-3-yl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[(1-methylpiperidin-3-yl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-[(1-methyl-3-piperidyl)methylsulfanyl]-1-oxido-pyridin-1-ium CAS Name: 2-[(1-methyl-3-piperidinyl)methylthio]-1-oxidopyridin-1-ium IUPAC Name: 2-[(1-methylpiperidin-3-yl)methylsulfanyl]-1-oxidopyridin-1-ium Traditional Name: 2-[(1-methyl-3-piperidyl)methylthio]-1-oxido-pyridin-1-ium Formula: C12H18N2OS MolecularWeight: 238.34912

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CN1CCCC(C1)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C12H18N2OS/c1-13-7-4-5-11(9-13)10-16-12-6-2-3-8-14(12)15/h2-3,6,8,11H,4-5,7,9-10H2,1H3