(2-phenyl-1,3-thiazol-4-yl)methyl 2-(3,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(3,4-dimethylphenyl)sulfanylethanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-(3,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(3,4-dimethylphenyl)thio]acetic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(3,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(3,4-dimethylphenyl)thio]acetic acid (2-phenylthiazol-4-yl)methyl ester Formula: C20H19NO2S2 MolecularWeight: 369.50036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)OCC2=CSC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)OCC2=CSC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H19NO2S2/c1-14-8-9-18(10-15(14)2)24-13-19(22)23-11-17-12-25-20(21-17)16-6-4-3-5-7-16/h3-10,12H,11,13H2,1-2H3