N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3,4,5-trimethoxyphenyl)acetamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-(3,4,5-trimethoxyphenyl)acetamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C21H24N2O4S/c1-25-18-10-15(11-19(26-2)21(18)27-3)12-20(24)23-8-9-28-14-17-7-5-4-6-16(17)13-22/h4-7,10-11H,8-9,12,14H2,1-3H3,(H,23,24)