N-(2,6-dimethylphenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide

Systemtic Name: N-(2,6-dimethylphenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide Openeye Name: N-(2,6-dimethylphenyl)-3-[2-(2-pyridyl)ethylsulfanyl]propanamide CAS Name: N-(2,6-dimethylphenyl)-3-[2-(2-pyridinyl)ethylthio]propanamide IUPAC Name: N-(2,6-dimethylphenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide Traditional Name: N-(2,6-dimethylphenyl)-3-[2-(2-pyridyl)ethylthio]propionamide Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCSCCC2=CC=CC=N2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCSCCC2=CC=CC=N2

InChI

InChI=1S/C18H22N2OS/c1-14-6-5-7-15(2)18(14)20-17(21)10-13-22-12-9-16-8-3-4-11-19-16/h3-8,11H,9-10,12-13H2,1-2H3,(H,20,21)