N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylsulfanyl-propanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylsulfanyl-propanamide Openeye Name: N-(3,5-dimethoxyphenyl)-3-(2-pyridylsulfanyl)propanamide CAS Name: N-(3,5-dimethoxyphenyl)-3-(2-pyridinylthio)propanamide IUPAC Name: N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylsulfanylpropanamide Traditional Name: N-(3,5-dimethoxyphenyl)-3-(2-pyridylthio)propionamide Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CCSC2=CC=CC=N2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CCSC2=CC=CC=N2)OC

InChI

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