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

Systemtic Name: 5-bromanyl-N-(2,6-diethyl-4-nitro-phenyl)-1,6-dimethyl-2-(methylsulfanylmethyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-bromo-N-(2,6-diethyl-4-nitro-phenyl)-1,6-dimethyl-2-(methylsulfanylmethyl)-4-oxo-pyridine-3-carboxamide CAS Name: 5-bromo-N-(2,6-diethyl-4-nitrophenyl)-1,6-dimethyl-2-[(methylthio)methyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-(2,6-diethyl-4-nitrophenyl)-1,6-dimethyl-2-(methylsulfanylmethyl)-4-oxopyridine-3-carboxamide Traditional Name: 5-bromo-N-(2,6-diethyl-4-nitro-phenyl)-4-keto-1,6-dimethyl-2-[(methylthio)methyl]nicotinamide Formula: C20H24BrN3O4S MolecularWeight: 482.39126

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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)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=CC(=C1NC(=O)C2=C(N(C(=C(C2=O)Br)C)C)CSC)CC)[N+](=O)[O-]

InChI

InChI=1S/C20H24BrN3O4S/c1-6-12-8-14(24(27)28)9-13(7-2)18(12)22-20(26)16-15(10-29-5)23(4)11(3)17(21)19(16)25/h8-9H,6-7,10H2,1-5H3,(H,22,26)