2-(3,4-dimethoxyphenyl)sulfanyl-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(4-pyridylmethyl)acetamide CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-N-(4-pyridylmethyl)acetamide Formula: C16H18N2O3S MolecularWeight: 318.39072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)NCC2=CC=NC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)NCC2=CC=NC=C2)OC

InChI

InChI=1S/C16H18N2O3S/c1-20-14-4-3-13(9-15(14)21-2)22-11-16(19)18-10-12-5-7-17-8-6-12/h3-9H,10-11H2,1-2H3,(H,18,19)