S-[1-(4-tert-butylphenyl)-2-imidazol-1-yl-ethyl] benzenecarbothioate

Systemtic Name: S-[1-(4-tert-butylphenyl)-2-imidazol-1-yl-ethyl] benzenecarbothioate Openeye Name: S-[1-(4-tert-butylphenyl)-2-imidazol-1-yl-ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[1-(4-tert-butylphenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: S-[1-(4-tert-butylphenyl)-2-imidazol-1-ylethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[1-(4-tert-butylphenyl)-2-imidazol-1-yl-ethyl] ester Formula: C22H24N2OS MolecularWeight: 364.50376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CN2C=CN=C2)SC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(CN2C=CN=C2)SC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2OS/c1-22(2,3)19-11-9-17(10-12-19)20(15-24-14-13-23-16-24)26-21(25)18-7-5-4-6-8-18/h4-14,16,20H,15H2,1-3H3