5-bromanyl-N-(2,6-diethyl-4-methyl-phenyl)-1,6-dimethyl-2-(methylsulfanylmethyl)-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-(2,6-diethyl-4-methyl-phenyl)-1,6-dimethyl-2-(methylsulfanylmethyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-bromo-N-(2,6-diethyl-4-methyl-phenyl)-1,6-dimethyl-2-(methylsulfanylmethyl)-4-oxo-pyridine-3-carboxamide CAS Name: 5-bromo-N-(2,6-diethyl-4-methylphenyl)-1,6-dimethyl-2-[(methylthio)methyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-(2,6-diethyl-4-methylphenyl)-1,6-dimethyl-2-(methylsulfanylmethyl)-4-oxopyridine-3-carboxamide Traditional Name: 5-bromo-N-(2,6-diethyl-4-methyl-phenyl)-4-keto-1,6-dimethyl-2-[(methylthio)methyl]nicotinamide Formula: C21H27BrN2O2S MolecularWeight: 451.42028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1NC(=O)C2=C(N(C(=C(C2=O)Br)C)C)CSC)CC)C

Isomeric SMILES

CCC1=CC(=CC(=C1NC(=O)C2=C(N(C(=C(C2=O)Br)C)C)CSC)CC)C

InChI

InChI=1S/C21H27BrN2O2S/c1-7-14-9-12(3)10-15(8-2)19(14)23-21(26)17-16(11-27-6)24(5)13(4)18(22)20(17)25/h9-10H,7-8,11H2,1-6H3,(H,23,26)