sulfanyl 2-methyl-2-(4-methyl-1,3-thiazol-5-yl)-3-phenyl-propanoate

Systemtic Name: sulfanyl 2-methyl-2-(4-methyl-1,3-thiazol-5-yl)-3-phenyl-propanoate Openeye Name: sulfanyl 2-methyl-2-(4-methylthiazol-5-yl)-3-phenyl-propanoate CAS Name: 2-methyl-2-(4-methyl-5-thiazolyl)-3-phenylpropanoic acid mercapto ester IUPAC Name: sulfanyl 2-methyl-2-(4-methyl-1,3-thiazol-5-yl)-3-phenylpropanoate Traditional Name: 2-methyl-2-(4-methylthiazol-5-yl)-3-phenyl-propionic acid mercapto ester Formula: C14H15NO2S2 MolecularWeight: 293.4044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)C(C)(CC2=CC=CC=C2)C(=O)OS

Isomeric SMILES

CC1=C(SC=N1)C(C)(CC2=CC=CC=C2)C(=O)OS

InChI

InChI=1S/C14H15NO2S2/c1-10-12(19-9-15-10)14(2,13(16)17-18)8-11-6-4-3-5-7-11/h3-7,9,18H,8H2,1-2H3