N-dibenzofuran-2-yl-5-(iodanylmethyl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine iodide

Systemtic Name: N-dibenzofuran-2-yl-5-(iodanylmethyl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine iodide Openeye Name: N-dibenzofuran-2-yl-5-(iodomethyl)-4,5-dihydrothiazol-3-ium-2-amine iodide CAS Name: N-(2-dibenzofuranyl)-5-(iodomethyl)-4,5-dihydrothiazol-3-ium-2-amine iodide IUPAC Name: N-dibenzofuran-2-yl-5-(iodomethyl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine iodide Traditional Name: dibenzofuran-2-yl-[5-(iodomethyl)-2-thiazolin-3-ium-2-yl]amine iodide Formula: C16H14I2N2OS MolecularWeight: 536.1691

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=[NH+]1)NC2=CC3=C(C=C2)OC4=CC=CC=C43)CI.[I-]

Isomeric SMILES

C1C(SC(=[NH+]1)NC2=CC3=C(C=C2)OC4=CC=CC=C43)CI.[I-]

InChI

InChI=1S/C16H13IN2OS.HI/c17-8-11-9-18-16(21-11)19-10-5-6-15-13(7-10)12-3-1-2-4-14(12)20-15;/h1-7,11H,8-9H2,(H,18,19);1H