4-(4-methoxyphenyl)-5-methyl-3-phenyl-N-prop-2-enyl-3H-1,3-thiazol-3-ium-2-imine bromide

Systemtic Name: 4-(4-methoxyphenyl)-5-methyl-3-phenyl-N-prop-2-enyl-3H-1,3-thiazol-3-ium-2-imine bromide Openeye Name: N-allyl-4-(4-methoxyphenyl)-5-methyl-3-phenyl-3H-thiazol-3-ium-2-imine bromide CAS Name: 4-(4-methoxyphenyl)-5-methyl-3-phenyl-N-prop-2-enyl-3H-thiazol-3-ium-2-imine bromide IUPAC Name: 4-(4-methoxyphenyl)-5-methyl-3-phenyl-N-prop-2-enyl-3H-1,3-thiazol-3-ium-2-imine bromide Traditional Name: allyl-[4-(4-methoxyphenyl)-5-methyl-3-phenyl-4-thiazolin-3-ium-2-ylidene]amine bromide Formula: C20H21BrN2OS MolecularWeight: 417.36254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+](C(=NCC=C)S1)C2=CC=CC=C2)C3=CC=C(C=C3)OC.[Br-]

Isomeric SMILES

CC1=C([NH+](C(=NCC=C)S1)C2=CC=CC=C2)C3=CC=C(C=C3)OC.[Br-]

InChI

InChI=1S/C20H20N2OS.BrH/c1-4-14-21-20-22(17-8-6-5-7-9-17)19(15(2)24-20)16-10-12-18(23-3)13-11-16;/h4-13H,1,14H2,2-3H3;1H