2-[4-methyl-3-(phenylmethyl)-4,5-dihydro-1,3-thiazol-3-ium-5-yl]ethanol; tetraphenylboranuide

Systemtic Name: 2-[4-methyl-3-(phenylmethyl)-4,5-dihydro-1,3-thiazol-3-ium-5-yl]ethanol; tetraphenylboranuide Openeye Name: 2-(3-benzyl-4-methyl-4,5-dihydrothiazol-3-ium-5-yl)ethanol; tetraphenylboranuide CAS Name: 2-[4-methyl-3-(phenylmethyl)-4,5-dihydrothiazol-3-ium-5-yl]ethanol; tetraphenylboranuide IUPAC Name: 2-(3-benzyl-4-methyl-4,5-dihydro-1,3-thiazol-3-ium-5-yl)ethanol; tetraphenylboranuide Traditional Name: 2-(3-benzyl-4-methyl-2-thiazolin-3-ium-5-yl)ethanol; tetraphenylboranuide Formula: C37H38BNOS MolecularWeight: 555.57972

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1C(SC=[N+]1CC2=CC=CC=C2)CCO

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1C(SC=[N+]1CC2=CC=CC=C2)CCO

InChI

InChI=1S/C24H20B.C13H18NOS/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;1-11-13(7-8-15)16-10-14(11)9-12-5-3-2-4-6-12/h1-20H;2-6,10-11,13,15H,7-9H2,1H3/q-1;+1