(3-methylphenyl)methyl 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate

Systemtic Name: (3-methylphenyl)methyl 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate Openeye Name: m-tolylmethyl 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate CAS Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate Traditional Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzoic acid (3-methylbenzyl) ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC=CC=C2SCC3=NC(=NO3)C

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC=CC=C2SCC3=NC(=NO3)C

InChI

InChI=1S/C19H18N2O3S/c1-13-6-5-7-15(10-13)11-23-19(22)16-8-3-4-9-17(16)25-12-18-20-14(2)21-24-18/h3-10H,11-12H2,1-2H3