methyl N-[3,5-bis(trifluoromethyl)phenyl]piperidine-1-carboximidothioate iodide

Systemtic Name: methyl N-[3,5-bis(trifluoromethyl)phenyl]piperidine-1-carboximidothioate iodide Openeye Name: methyl N-[3,5-bis(trifluoromethyl)phenyl]piperidine-1-carboximidothioate iodide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-piperidinecarboximidothioic acid methyl ester iodide IUPAC Name: methyl N-[3,5-bis(trifluoromethyl)phenyl]piperidine-1-carboximidothioate iodide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]piperidine-1-carboximidothioic acid methyl ester iodide Formula: C15H16F6IN2S- MolecularWeight: 497.260829

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)N2CCCCC2.[I-]

Isomeric SMILES

CSC(=NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)N2CCCCC2.[I-]

InChI

InChI=1S/C15H16F6N2S.HI/c1-24-13(23-5-3-2-4-6-23)22-12-8-10(14(16,17)18)7-11(9-12)15(19,20)21;/h7-9H,2-6H2,1H3;1H/p-1