3-methyl-5-(2,4,6-triphenylpyridin-1-ium-1-yl)-1,2-thiazole tetrafluoroborate

Systemtic Name: 3-methyl-5-(2,4,6-triphenylpyridin-1-ium-1-yl)-1,2-thiazole tetrafluoroborate Openeye Name: 3-methyl-5-(2,4,6-triphenylpyridin-1-ium-1-yl)isothiazole tetrafluoroborate CAS Name: 3-methyl-5-(2,4,6-triphenyl-1-pyridin-1-iumyl)isothiazole tetrafluoroborate IUPAC Name: 3-methyl-5-(2,4,6-triphenylpyridin-1-ium-1-yl)-1,2-thiazole tetrafluoroborate Traditional Name: 3-methyl-5-(2,4,6-triphenylpyridin-1-ium-1-yl)isothiazole tetrafluoroborate Formula: C27H21BF4N2S MolecularWeight: 492.338653

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=NSC(=C1)[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

[B-](F)(F)(F)F.CC1=NSC(=C1)[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H21N2S.BF4/c1-20-17-27(30-28-20)29-25(22-13-7-3-8-14-22)18-24(21-11-5-2-6-12-21)19-26(29)23-15-9-4-10-16-23;2-1(3,4)5/h2-19H,1H3;/q+1;-1