2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetamide Traditional Name: N-benzyl-2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]acetamide Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C17H17N3OS/c1-12-8-13(2)20-17(15(12)9-18)22-11-16(21)19-10-14-6-4-3-5-7-14/h3-8H,10-11H2,1-2H3,(H,19,21)