2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C22H21N3OS2 MolecularWeight: 407.55164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=C(C(=CC(=N3)C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=C(C(=CC(=N3)C)C)C#N

InChI

InChI=1S/C22H21N3OS2/c1-14-6-8-17(9-7-14)21(19-5-4-10-27-19)25-20(26)13-28-22-18(12-23)15(2)11-16(3)24-22/h4-11,21H,13H2,1-3H3,(H,25,26)