ethyl 5-(2,2-dimethylpropyl)-2-methylsulfanyl-1,3-oxazole-4-carboxylate

Systemtic Name: ethyl 5-(2,2-dimethylpropyl)-2-methylsulfanyl-1,3-oxazole-4-carboxylate Openeye Name: ethyl 5-(2,2-dimethylpropyl)-2-methylsulfanyl-oxazole-4-carboxylate CAS Name: 5-(2,2-dimethylpropyl)-2-(methylthio)-4-oxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2,2-dimethylpropyl)-2-methylsulfanyl-1,3-oxazole-4-carboxylate Traditional Name: 2-(methylthio)-5-neopentyl-oxazole-4-carboxylic acid ethyl ester Formula: C12H19NO3S MolecularWeight: 257.34916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=N1)SC)CC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=N1)SC)CC(C)(C)C

InChI

InChI=1S/C12H19NO3S/c1-6-15-10(14)9-8(7-12(2,3)4)16-11(13-9)17-5/h6-7H2,1-5H3