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

Systemtic Name: 4-(4-bromophenyl)-N-(2,3-dimethylphenyl)-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine Openeye Name: 3-allyl-4-(4-bromophenyl)-N-(2,3-dimethylphenyl)thiazol-3-ium-2-amine CAS Name: 4-(4-bromophenyl)-N-(2,3-dimethylphenyl)-3-prop-2-enyl-2-thiazol-3-iumamine IUPAC Name: 4-(4-bromophenyl)-N-(2,3-dimethylphenyl)-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine Traditional Name: [3-allyl-4-(4-bromophenyl)thiazol-3-ium-2-yl]-(2,3-dimethylphenyl)amine Formula: C20H20BrN2S+ MolecularWeight: 400.3552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Br)CC=C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Br)CC=C)C

InChI

InChI=1S/C20H19BrN2S/c1-4-12-23-19(16-8-10-17(21)11-9-16)13-24-20(23)22-18-7-5-6-14(2)15(18)3/h4-11,13H,1,12H2,2-3H3/p+1