[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C21H21NO4S2 MolecularWeight: 415.52574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OCC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OCC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H21NO4S2/c1-14-6-4-5-7-19(14)27-13-20(23)26-11-16-12-28-21(22-16)15-8-9-17(24-2)18(10-15)25-3/h4-10,12H,11,13H2,1-3H3