N,4-bis(4-methylphenyl)-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: N,4-bis(4-methylphenyl)-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 3-allyl-N,4-bis(p-tolyl)thiazol-3-ium-2-amine bromide CAS Name: N,4-bis(4-methylphenyl)-3-prop-2-enyl-2-thiazol-3-iumamine bromide IUPAC Name: N,4-bis(4-methylphenyl)-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: [3-allyl-4-(p-tolyl)thiazol-3-ium-2-yl]-(p-tolyl)amine bromide Formula: C20H21BrN2S MolecularWeight: 401.36314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=[N+]2CC=C)NC3=CC=C(C=C3)C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=[N+]2CC=C)NC3=CC=C(C=C3)C.[Br-]

InChI

InChI=1S/C20H20N2S.BrH/c1-4-13-22-19(17-9-5-15(2)6-10-17)14-23-20(22)21-18-11-7-16(3)8-12-18;/h4-12,14H,1,13H2,2-3H3;1H