(2-cyanophenyl)methyl 2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]ethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]ethanoate Openeye Name: (2-cyanophenyl)methyl 2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]acetate CAS Name: 2-[(4,5-dimethoxy-2-methylphenyl)methylthio]acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]acetate Traditional Name: 2-[(4,5-dimethoxy-2-methyl-benzyl)thio]acetic acid (2-cyanobenzyl) ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSCC(=O)OCC2=CC=CC=C2C#N)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSCC(=O)OCC2=CC=CC=C2C#N)OC)OC

InChI

InChI=1S/C20H21NO4S/c1-14-8-18(23-2)19(24-3)9-17(14)12-26-13-20(22)25-11-16-7-5-4-6-15(16)10-21/h4-9H,11-13H2,1-3H3