S-[1-(triphenylmethyl)imidazol-4-yl] benzenecarbothioate

Systemtic Name: S-[1-(triphenylmethyl)imidazol-4-yl] benzenecarbothioate Openeye Name: S-(1-tritylimidazol-4-yl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-[1-(triphenylmethyl)-4-imidazolyl] ester IUPAC Name: S-(1-tritylimidazol-4-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(1-tritylimidazol-4-yl) ester Formula: C29H22N2OS MolecularWeight: 446.56278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H22N2OS/c32-28(23-13-5-1-6-14-23)33-27-21-31(22-30-27)29(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H