2-[4-(4-bromophenyl)-2,6-diphenyl-phenyl]-3-methyl-1,3-thiazol-3-ium perchlorate

Systemtic Name: 2-[4-(4-bromophenyl)-2,6-diphenyl-phenyl]-3-methyl-1,3-thiazol-3-ium perchlorate Openeye Name: 2-[4-(4-bromophenyl)-2,6-diphenyl-phenyl]-3-methyl-thiazol-3-ium perchlorate CAS Name: 2-[4-(4-bromophenyl)-2,6-diphenylphenyl]-3-methylthiazol-3-ium perchlorate IUPAC Name: 2-[4-(4-bromophenyl)-2,6-diphenylphenyl]-3-methyl-1,3-thiazol-3-ium perchlorate Traditional Name: 2-[4-(4-bromophenyl)-2,6-diphenyl-phenyl]-3-methyl-thiazol-3-ium perchlorate Formula: C28H21BrClNO4S MolecularWeight: 582.89264

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC=C1)C2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)Br)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=C(SC=C1)C2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)Br)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H21BrNS.ClHO4/c1-30-16-17-31-28(30)27-25(21-8-4-2-5-9-21)18-23(20-12-14-24(29)15-13-20)19-26(27)22-10-6-3-7-11-22;2-1(3,4)5/h2-19H,1H3;(H,2,3,4,5)/q+1;/p-1