ethyl 2-[4-[[2-(4-bromophenyl)-4-methyl-1,3-thiazol-5-yl]methylsulfanyl]-2-methyl-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[[2-(4-bromophenyl)-4-methyl-1,3-thiazol-5-yl]methylsulfanyl]-2-methyl-phenoxy]ethanoate Openeye Name: ethyl 2-[4-[[2-(4-bromophenyl)-4-methyl-thiazol-5-yl]methylsulfanyl]-2-methyl-phenoxy]acetate CAS Name: 2-[4-[[2-(4-bromophenyl)-4-methyl-5-thiazolyl]methylthio]-2-methylphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[2-(4-bromophenyl)-4-methyl-1,3-thiazol-5-yl]methylsulfanyl]-2-methylphenoxy]acetate Traditional Name: 2-[4-[[2-(4-bromophenyl)-4-methyl-thiazol-5-yl]methylthio]-2-methyl-phenoxy]acetic acid ethyl ester Formula: C22H22BrNO3S2 MolecularWeight: 492.44898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)SCC2=C(N=C(S2)C3=CC=C(C=C3)Br)C)C

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)SCC2=C(N=C(S2)C3=CC=C(C=C3)Br)C)C

InChI

InChI=1S/C22H22BrNO3S2/c1-4-26-21(25)12-27-19-10-9-18(11-14(19)2)28-13-20-15(3)24-22(29-20)16-5-7-17(23)8-6-16/h5-11H,4,12-13H2,1-3H3