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

Systemtic Name: 3-methyl-2-[4-(4-methylphenyl)-2,6-diphenyl-phenyl]-1,3-thiazol-3-ium perchlorate Openeye Name: 2-[2,6-diphenyl-4-(p-tolyl)phenyl]-3-methyl-thiazol-3-ium perchlorate CAS Name: 3-methyl-2-[4-(4-methylphenyl)-2,6-diphenylphenyl]thiazol-3-ium perchlorate IUPAC Name: 3-methyl-2-[4-(4-methylphenyl)-2,6-diphenylphenyl]-1,3-thiazol-3-ium perchlorate Traditional Name: 2-[2,6-diphenyl-4-(p-tolyl)phenyl]-3-methyl-thiazol-3-ium perchlorate Formula: C29H24ClNO4S MolecularWeight: 518.02316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C(=C2)C3=CC=CC=C3)C4=[N+](C=CS4)C)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C(=C2)C3=CC=CC=C3)C4=[N+](C=CS4)C)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C29H24NS.ClHO4/c1-21-13-15-22(16-14-21)25-19-26(23-9-5-3-6-10-23)28(29-30(2)17-18-31-29)27(20-25)24-11-7-4-8-12-24;2-1(3,4)5/h3-20H,1-2H3;(H,2,3,4,5)/q+1;/p-1