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2-methyl-N-[(4-methylpiperidin-1-ium-1-ylidene)-methylsulfanyl-methyl]propan-1-amine iodide

2-methyl-N-[(4-methylpiperidin-1-ium-1-ylidene)-methylsulfanyl-methyl]propan-1-amine iodide

Systemtic Name:2-methyl-N-[(4-methylpiperidin-1-ium-1-ylidene)-methylsulfanyl-methyl]propan-1-amine iodide
Openeye Name:2-methyl-N-[(4-methylpiperidin-1-ium-1-ylidene)-methylsulfanyl-methyl]propan-1-amine iodide
CAS Name:2-methyl-N-[(4-methyl-1-piperidin-1-iumylidene)-(methylthio)methyl]-1-propanamine iodide
IUPAC Name:2-methyl-N-[(4-methylpiperidin-1-ium-1-ylidene)-methylsulfanylmethyl]propan-1-amine iodide
Traditional Name:isobutyl-[(4-methylpiperidin-1-ium-1-ylidene)-(methylthio)methyl]amine iodide
Formula: C12H25IN2S
MolecularWeight: 356.30977
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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[N+](=C(NCC(C)C)SC)CC1.[I-]


Isomeric SMILES

CC1CC[N+](=C(NCC(C)C)SC)CC1.[I-]


InChI

InChI=1S/C12H24N2S.HI/c1-10(2)9-13-12(15-4)14-7-5-11(3)6-8-14;/h10-11H,5-9H2,1-4H3;1H


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