N-(4-bromophenyl)-2-[(3-cyano-5-ethanoyl-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[(3-cyano-5-ethanoyl-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-acetyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide CAS Name: 2-[(5-acetyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)thio]-N-(4-bromophenyl)acetamide IUPAC Name: 2-[(5-acetyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide Traditional Name: 2-[(5-acetyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)thio]-N-(4-bromophenyl)acetamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(NC(=C1C(=O)C)C)SCC(=O)NC2=CC=C(C=C2)Br)C#N

Isomeric SMILES

CC1C(=C(NC(=C1C(=O)C)C)SCC(=O)NC2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C18H18BrN3O2S/c1-10-15(8-20)18(21-11(2)17(10)12(3)23)25-9-16(24)22-14-6-4-13(19)5-7-14/h4-7,10,21H,9H2,1-3H3,(H,22,24)