N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3,5-dimethoxyphenyl)propanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3,5-dimethoxyphenyl)propanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3,5-dimethoxyphenyl)propanamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-(3,5-dimethoxyphenyl)propanamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3,5-dimethoxyphenyl)propanamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-3-(3,5-dimethoxyphenyl)propionamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)NCCSCC2=CC=CC=C2C#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)NCCSCC2=CC=CC=C2C#N)OC

InChI

InChI=1S/C21H24N2O3S/c1-25-19-11-16(12-20(13-19)26-2)7-8-21(24)23-9-10-27-15-18-6-4-3-5-17(18)14-22/h3-6,11-13H,7-10,15H2,1-2H3,(H,23,24)