[1-(4-tert-butylphenyl)-2-imidazol-1-yl-ethyl] (4-chlorophenyl)methoxysulfanylmethanoate

Systemtic Name: [1-(4-tert-butylphenyl)-2-imidazol-1-yl-ethyl] (4-chlorophenyl)methoxysulfanylmethanoate Openeye Name: [1-(4-tert-butylphenyl)-2-imidazol-1-yl-ethyl] (4-chlorophenyl)methoxysulfanylformate CAS Name: [(4-chlorophenyl)methoxythio]formic acid [1-(4-tert-butylphenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: [1-(4-tert-butylphenyl)-2-imidazol-1-ylethyl] (4-chlorophenyl)methoxysulfanylformate Traditional Name: [(4-chlorobenzyl)oxythio]formic acid [1-(4-tert-butylphenyl)-2-imidazol-1-yl-ethyl] ester Formula: C23H25ClN2O3S MolecularWeight: 444.9742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CN2C=CN=C2)OC(=O)SOCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(CN2C=CN=C2)OC(=O)SOCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H25ClN2O3S/c1-23(2,3)19-8-6-18(7-9-19)21(14-26-13-12-25-16-26)29-22(27)30-28-15-17-4-10-20(24)11-5-17/h4-13,16,21H,14-15H2,1-3H3