N-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-chloranyl-3-methyl-phenyl)-3-ethyl-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-(4-chloranyl-3-methyl-phenyl)-3-ethyl-1,3-thiazol-3-ium-2-amine bromide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-(4-chloro-3-methyl-phenyl)-3-ethyl-thiazol-3-ium-2-amine bromide CAS Name: N-(3-chloro-4-fluorophenyl)-4-(4-chloro-3-methylphenyl)-3-ethyl-2-thiazol-3-iumamine bromide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-(4-chloro-3-methylphenyl)-3-ethyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: (3-chloro-4-fluoro-phenyl)-[4-(4-chloro-3-methyl-phenyl)-3-ethyl-thiazol-3-ium-2-yl]amine bromide Formula: C18H16BrCl2FN2S MolecularWeight: 462.206443

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC=C1C2=CC(=C(C=C2)Cl)C)NC3=CC(=C(C=C3)F)Cl.[Br-]

Isomeric SMILES

CC[N+]1=C(SC=C1C2=CC(=C(C=C2)Cl)C)NC3=CC(=C(C=C3)F)Cl.[Br-]

InChI

InChI=1S/C18H15Cl2FN2S.BrH/c1-3-23-17(12-4-6-14(19)11(2)8-12)10-24-18(23)22-13-5-7-16(21)15(20)9-13;/h4-10H,3H2,1-2H3;1H