3-ethyl-2-methyl-4,5-diphenyl-1,3-thiazol-3-ium perchlorate

Systemtic Name: 3-ethyl-2-methyl-4,5-diphenyl-1,3-thiazol-3-ium perchlorate Openeye Name: 3-ethyl-2-methyl-4,5-diphenyl-thiazol-3-ium perchlorate CAS Name: 3-ethyl-2-methyl-4,5-diphenylthiazol-3-ium perchlorate IUPAC Name: 3-ethyl-2-methyl-4,5-diphenyl-1,3-thiazol-3-ium perchlorate Traditional Name: 3-ethyl-2-methyl-4,5-diphenyl-thiazol-3-ium perchlorate Formula: C18H18ClNO4S MolecularWeight: 379.85782

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC(=C1C2=CC=CC=C2)C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC[N+]1=C(SC(=C1C2=CC=CC=C2)C3=CC=CC=C3)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H18NS.ClHO4/c1-3-19-14(2)20-18(16-12-8-5-9-13-16)17(19)15-10-6-4-7-11-15;2-1(3,4)5/h4-13H,3H2,1-2H3;(H,2,3,4,5)/q+1;/p-1