5-(iodanylmethyl)-N-(6-methylpyridin-2-yl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine iodide

Systemtic Name: 5-(iodanylmethyl)-N-(6-methylpyridin-2-yl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine iodide Openeye Name: 5-(iodomethyl)-N-(6-methyl-2-pyridyl)-4,5-dihydrothiazol-3-ium-2-amine iodide CAS Name: 5-(iodomethyl)-N-(6-methyl-2-pyridinyl)-4,5-dihydrothiazol-3-ium-2-amine iodide IUPAC Name: 5-(iodomethyl)-N-(6-methylpyridin-2-yl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine iodide Traditional Name: [5-(iodomethyl)-2-thiazolin-3-ium-2-yl]-(6-methyl-2-pyridyl)amine iodide Formula: C10H13I2N3S MolecularWeight: 461.10426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC2=[NH+]CC(S2)CI.[I-]

Isomeric SMILES

CC1=NC(=CC=C1)NC2=[NH+]CC(S2)CI.[I-]

InChI

InChI=1S/C10H12IN3S.HI/c1-7-3-2-4-9(13-7)14-10-12-6-8(5-11)15-10;/h2-4,8H,5-6H2,1H3,(H,12,13,14);1H