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

Systemtic Name: 5-(iodanylmethyl)-N-pyridin-2-yl-4,5-dihydro-1,3-thiazol-3-ium-2-amine iodide Openeye Name: 5-(iodomethyl)-N-(2-pyridyl)-4,5-dihydrothiazol-3-ium-2-amine iodide CAS Name: 5-(iodomethyl)-N-(2-pyridinyl)-4,5-dihydrothiazol-3-ium-2-amine iodide IUPAC Name: 5-(iodomethyl)-N-pyridin-2-yl-4,5-dihydro-1,3-thiazol-3-ium-2-amine iodide Traditional Name: [5-(iodomethyl)-2-thiazolin-3-ium-2-yl]-(2-pyridyl)amine iodide Formula: C9H11I2N3S MolecularWeight: 447.07768

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=[NH+]1)NC2=CC=CC=N2)CI.[I-]

Isomeric SMILES

C1C(SC(=[NH+]1)NC2=CC=CC=N2)CI.[I-]

InChI

InChI=1S/C9H10IN3S.HI/c10-5-7-6-12-9(14-7)13-8-3-1-2-4-11-8;/h1-4,7H,5-6H2,(H,11,12,13);1H