2-[[4-(3-bromophenyl)-5-cyano-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(3-chloranyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[[4-(3-bromophenyl)-5-cyano-2-oxidanylidene-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(3-chloranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[4-(3-bromophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(3-chloro-2-methyl-phenyl)acetamide CAS Name: 2-[[4-(3-bromophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridin-6-yl]thio]-N-(3-chloro-2-methylphenyl)acetamide IUPAC Name: 2-[[4-(3-bromophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(3-chloro-2-methylphenyl)acetamide Traditional Name: 2-[[4-(3-bromophenyl)-5-cyano-2-keto-3,4-dihydro-1H-pyridin-6-yl]thio]-N-(3-chloro-2-methyl-phenyl)acetamide Formula: C21H17BrClN3O2S MolecularWeight: 490.80058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC(=CC=C3)Br)C#N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC(=CC=C3)Br)C#N

InChI

InChI=1S/C21H17BrClN3O2S/c1-12-17(23)6-3-7-18(12)25-20(28)11-29-21-16(10-24)15(9-19(27)26-21)13-4-2-5-14(22)8-13/h2-8,15H,9,11H2,1H3,(H,25,28)(H,26,27)