methyl N'-(2-methyl-6-piperidin-1-yl-phenyl)carbamimidothioate hydroiodide

Systemtic Name: methyl N'-(2-methyl-6-piperidin-1-yl-phenyl)carbamimidothioate hydroiodide Openeye Name: 2-methyl-3-[2-methyl-6-(1-piperidyl)phenyl]isothiourea hydroiodide CAS Name: N'-[2-methyl-6-(1-piperidinyl)phenyl]carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-(2-methyl-6-piperidin-1-ylphenyl)carbamimidothioate hydroiodide Traditional Name: 2-methyl-3-(2-methyl-6-piperidino-phenyl)isothiourea hydroiodide Formula: C14H22IN3S MolecularWeight: 391.31405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCCCC2)N=C(N)SC.I

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCCCC2)N=C(N)SC.I

InChI

InChI=1S/C14H21N3S.HI/c1-11-7-6-8-12(13(11)16-14(15)18-2)17-9-4-3-5-10-17;/h6-8H,3-5,9-10H2,1-2H3,(H2,15,16);1H