methyl 2-(4-methylphenyl)-5-methylsulfanyl-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-(4-methylphenyl)-5-methylsulfanyl-1,3-oxazole-4-carboxylate Openeye Name: methyl 5-methylsulfanyl-2-(p-tolyl)oxazole-4-carboxylate CAS Name: 2-(4-methylphenyl)-5-(methylthio)-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-methylphenyl)-5-methylsulfanyl-1,3-oxazole-4-carboxylate Traditional Name: 5-(methylthio)-2-(p-tolyl)oxazole-4-carboxylic acid methyl ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(O2)SC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(O2)SC)C(=O)OC

InChI

InChI=1S/C13H13NO3S/c1-8-4-6-9(7-5-8)11-14-10(12(15)16-2)13(17-11)18-3/h4-7H,1-3H3