N-(4-bromophenyl)-4-(4-methoxyphenyl)-5-methyl-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine

Systemtic Name: N-(4-bromophenyl)-4-(4-methoxyphenyl)-5-methyl-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine Openeye Name: 3-allyl-N-(4-bromophenyl)-4-(4-methoxyphenyl)-5-methyl-thiazol-3-ium-2-amine CAS Name: N-(4-bromophenyl)-4-(4-methoxyphenyl)-5-methyl-3-prop-2-enyl-2-thiazol-3-iumamine IUPAC Name: N-(4-bromophenyl)-4-(4-methoxyphenyl)-5-methyl-3-prop-2-enyl-1,3-thiazol-3-ium-2-amine Traditional Name: [3-allyl-4-(4-methoxyphenyl)-5-methyl-thiazol-3-ium-2-yl]-(4-bromophenyl)amine Formula: C20H20BrN2OS+ MolecularWeight: 416.3546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=C(S1)NC2=CC=C(C=C2)Br)CC=C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C([N+](=C(S1)NC2=CC=C(C=C2)Br)CC=C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19BrN2OS/c1-4-13-23-19(15-5-11-18(24-3)12-6-15)14(2)25-20(23)22-17-9-7-16(21)8-10-17/h4-12H,1,13H2,2-3H3/p+1