2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(3,5-dimethylphenyl)methylthio]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[(3,5-dimethylbenzyl)thio]-N-(3-pyridylmethyl)acetamide Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSCC(=O)NCC2=CN=CC=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSCC(=O)NCC2=CN=CC=C2)C

InChI

InChI=1S/C17H20N2OS/c1-13-6-14(2)8-16(7-13)11-21-12-17(20)19-10-15-4-3-5-18-9-15/h3-9H,10-12H2,1-2H3,(H,19,20)