2-[(E)-(2-chloranyl-1-phenyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-methyl-2H-1,3-benzothiazole iodide

Systemtic Name: 2-[(E)-(2-chloranyl-1-phenyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-methyl-2H-1,3-benzothiazole iodide Openeye Name: 2-[(E)-(2-chloro-1-phenyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-methyl-2H-1,3-benzothiazole iodide CAS Name: 2-[(E)-(2-chloro-1-phenyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-methyl-2H-1,3-benzothiazole iodide IUPAC Name: 2-[(E)-(2-chloro-1-phenyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-methyl-2H-1,3-benzothiazole iodide Traditional Name: 2-[(E)-(2-chloro-1-phenyl-1H-quinolin-1-ium-4-ylidene)methyl]-3-methyl-2H-1,3-benzothiazole iodide Formula: C24H20ClIN2S MolecularWeight: 530.85147

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(SC2=CC=CC=C21)C=C3C=C([NH+](C4=CC=CC=C43)C5=CC=CC=C5)Cl.[I-]

Isomeric SMILES

CN1C(SC2=CC=CC=C21)/C=C/3\C=C([NH+](C4=CC=CC=C43)C5=CC=CC=C5)Cl.[I-]

InChI

InChI=1S/C24H19ClN2S.HI/c1-26-21-13-7-8-14-22(21)28-24(26)16-17-15-23(25)27(18-9-3-2-4-10-18)20-12-6-5-11-19(17)20;/h2-16,24H,1H3;1H/b17-16+;