4-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: 4-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]benzamide Openeye Name: 4-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanylmethyl]benzamide CAS Name: 4-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]benzamide IUPAC Name: 4-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylmethyl]benzamide Traditional Name: 4-[[(3-cyano-4,6-dimethyl-2-pyridyl)thio]methyl]benzamide Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=CC=C(C=C2)C(=O)N)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=CC=C(C=C2)C(=O)N)C

InChI

InChI=1S/C16H15N3OS/c1-10-7-11(2)19-16(14(10)8-17)21-9-12-3-5-13(6-4-12)15(18)20/h3-7H,9H2,1-2H3,(H2,18,20)