methyl (NE)-N-(3-methyl-1,3-thiazolidin-2-ylidene)-N'-phenyl-carbamimidothioate hydroiodide

Systemtic Name: methyl (NE)-N-(3-methyl-1,3-thiazolidin-2-ylidene)-N'-phenyl-carbamimidothioate hydroiodide Openeye Name: (1E)-2-methyl-1-(3-methylthiazolidin-2-ylidene)-3-phenyl-isothiourea hydroiodide CAS Name: (NE)-N-(3-methyl-2-thiazolidinylidene)-N'-phenylcarbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl (NE)-N-(3-methyl-1,3-thiazolidin-2-ylidene)-N'-phenylcarbamimidothioate hydroiodide Traditional Name: (1E)-2-methyl-1-(3-methylthiazolidin-2-ylidene)-3-phenyl-isothiourea hydroiodide Formula: C12H16IN3S2 MolecularWeight: 393.31001

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCSC1=NC(=NC2=CC=CC=C2)SC.I

Isomeric SMILES

CN\1CCS/C1=N/C(=NC2=CC=CC=C2)SC.I

InChI

InChI=1S/C12H15N3S2.HI/c1-15-8-9-17-12(15)14-11(16-2)13-10-6-4-3-5-7-10;/h3-7H,8-9H2,1-2H3;1H/b13-11?,14-12+;