1-[(1-methylquinolin-1-ium-2-yl)methylideneamino]thiourea iodide

Systemtic Name: 1-[(1-methylquinolin-1-ium-2-yl)methylideneamino]thiourea iodide Openeye Name: [(1-methylquinolin-1-ium-2-yl)methyleneamino]thiourea iodide CAS Name: [(1-methyl-2-quinolin-1-iumyl)methylideneamino]thiourea iodide IUPAC Name: [(1-methylquinolin-1-ium-2-yl)methylideneamino]thiourea iodide Traditional Name: [(1-methylquinolin-1-ium-2-yl)methyleneamino]thiourea iodide Formula: C12H13IN4S MolecularWeight: 372.22789

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC2=CC=CC=C21)C=NNC(=S)N.[I-]

Isomeric SMILES

C[N+]1=C(C=CC2=CC=CC=C21)C=NNC(=S)N.[I-]

InChI

InChI=1S/C12H12N4S.HI/c1-16-10(8-14-15-12(13)17)7-6-9-4-2-3-5-11(9)16;/h2-8H,1H3,(H2,13,17);1H