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

Systemtic Name: 2-[2,6-bis(4-bromophenyl)-4-phenyl-phenyl]-3-methyl-1,3-thiazol-3-ium perchlorate Openeye Name: 2-[2,6-bis(4-bromophenyl)-4-phenyl-phenyl]-3-methyl-thiazol-3-ium perchlorate CAS Name: 2-[2,6-bis(4-bromophenyl)-4-phenylphenyl]-3-methylthiazol-3-ium perchlorate IUPAC Name: 2-[2,6-bis(4-bromophenyl)-4-phenylphenyl]-3-methyl-1,3-thiazol-3-ium perchlorate Traditional Name: 2-[2,6-bis(4-bromophenyl)-4-phenyl-phenyl]-3-methyl-thiazol-3-ium perchlorate Formula: C28H20Br2ClNO4S MolecularWeight: 661.7887

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H20Br2NS.ClHO4/c1-31-15-16-32-28(31)27-25(20-7-11-23(29)12-8-20)17-22(19-5-3-2-4-6-19)18-26(27)21-9-13-24(30)14-10-21;2-1(3,4)5/h2-18H,1H3;(H,2,3,4,5)/q+1;/p-1