[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 4-(methylsulfonylmethyl)benzoate

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 4-(methylsulfonylmethyl)benzoate Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]methyl 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [2-(4-ethylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid [2-(4-ethylphenyl)thiazol-4-yl]methyl ester Formula: C21H21NO4S2 MolecularWeight: 415.52574

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)CS(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)CS(=O)(=O)C

InChI

InChI=1S/C21H21NO4S2/c1-3-15-4-8-17(9-5-15)20-22-19(13-27-20)12-26-21(23)18-10-6-16(7-11-18)14-28(2,24)25/h4-11,13H,3,12,14H2,1-2H3