3-ethyl-2-methyl-4,5-dihydro-1,3-thiazol-3-ium; tetraphenylboranuide

Systemtic Name: 3-ethyl-2-methyl-4,5-dihydro-1,3-thiazol-3-ium; tetraphenylboranuide Openeye Name: 3-ethyl-2-methyl-4,5-dihydrothiazol-3-ium; tetraphenylboranuide CAS Name: 3-ethyl-2-methyl-4,5-dihydrothiazol-3-ium; tetraphenylboranuide IUPAC Name: 3-ethyl-2-methyl-4,5-dihydro-1,3-thiazol-3-ium; tetraphenylboranuide Traditional Name: 3-ethyl-2-methyl-2-thiazolin-3-ium; tetraphenylboranuide Formula: C30H32BNS MolecularWeight: 449.45778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC[N+]1=C(SCC1)C

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC[N+]1=C(SCC1)C

InChI

InChI=1S/C24H20B.C6H12NS/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-3-7-4-5-8-6(7)2/h1-20H;3-5H2,1-2H3/q-1;+1