N-(3-bromophenyl)-4-methyl-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: N-(3-bromophenyl)-4-methyl-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 3-allyl-N-(3-bromophenyl)-4-methyl-thiazol-3-ium-2-amine bromide CAS Name: N-(3-bromophenyl)-4-methyl-3-prop-2-enyl-2-thiazol-3-iumamine bromide IUPAC Name: N-(3-bromophenyl)-4-methyl-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: (3-allyl-4-methyl-thiazol-3-ium-2-yl)-(3-bromophenyl)amine bromide Formula: C13H14Br2N2S MolecularWeight: 390.13666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=[N+]1CC=C)NC2=CC(=CC=C2)Br.[Br-]

Isomeric SMILES

CC1=CSC(=[N+]1CC=C)NC2=CC(=CC=C2)Br.[Br-]

InChI

InChI=1S/C13H13BrN2S.BrH/c1-3-7-16-10(2)9-17-13(16)15-12-6-4-5-11(14)8-12;/h3-6,8-9H,1,7H2,2H3;1H