4-methyl-2-phenyl-4-(1-sulfanylethyl)-1,3-oxazol-5-one

Systemtic Name: 4-methyl-2-phenyl-4-(1-sulfanylethyl)-1,3-oxazol-5-one Openeye Name: 4-methyl-2-phenyl-4-(1-sulfanylethyl)oxazol-5-one CAS Name: 4-(1-mercaptoethyl)-4-methyl-2-phenyl-5-oxazolone IUPAC Name: 4-methyl-2-phenyl-4-(1-sulfanylethyl)-1,3-oxazol-5-one Traditional Name: 4-(1-mercaptoethyl)-4-methyl-2-phenyl-2-oxazolin-5-one Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(C(=O)OC(=N1)C2=CC=CC=C2)C)S

Isomeric SMILES

CC(C1(C(=O)OC(=N1)C2=CC=CC=C2)C)S

InChI

InChI=1S/C12H13NO2S/c1-8(16)12(2)11(14)15-10(13-12)9-6-4-3-5-7-9/h3-8,16H,1-2H3