(2,5-dimethylphenyl)methyl 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: (2,5-dimethylphenyl)methyl 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: (2,5-dimethylphenyl)methyl 2-[(4-methylthiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 2-[[(4-methyl-2-thiazolyl)thio]methyl]benzoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 2-[[(4-methylthiazol-2-yl)thio]methyl]benzoic acid (2,5-dimethylbenzyl) ester Formula: C21H21NO2S2 MolecularWeight: 383.52694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C2=CC=CC=C2CSC3=NC(=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C2=CC=CC=C2CSC3=NC(=CS3)C

InChI

InChI=1S/C21H21NO2S2/c1-14-8-9-15(2)18(10-14)11-24-20(23)19-7-5-4-6-17(19)13-26-21-22-16(3)12-25-21/h4-10,12H,11,13H2,1-3H3