N-(4-bromophenyl)-2-(3-cyano-5-ethyl-4,6-dimethyl-pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-(3-cyano-5-ethyl-4,6-dimethyl-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[(3-cyano-5-ethyl-4,6-dimethyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[(3-cyano-5-ethyl-4,6-dimethyl-2-pyridinyl)thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-(3-cyano-5-ethyl-4,6-dimethylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[(3-cyano-5-ethyl-4,6-dimethyl-2-pyridyl)thio]acetamide Formula: C18H18BrN3OS MolecularWeight: 404.32402

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(C(=C1C)C#N)SCC(=O)NC2=CC=C(C=C2)Br)C

Isomeric SMILES

CCC1=C(N=C(C(=C1C)C#N)SCC(=O)NC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C18H18BrN3OS/c1-4-15-11(2)16(9-20)18(21-12(15)3)24-10-17(23)22-14-7-5-13(19)6-8-14/h5-8H,4,10H2,1-3H3,(H,22,23)