2,6-bis(bromanyl)-4-[(4R)-5-cyano-6-methylsulfanyl-2-oxidanylidene-3,4-dihydro-1H-pyridin-4-yl]phenolate

Systemtic Name: 2,6-bis(bromanyl)-4-[(4R)-5-cyano-6-methylsulfanyl-2-oxidanylidene-3,4-dihydro-1H-pyridin-4-yl]phenolate Openeye Name: 2,6-dibromo-4-[(4R)-5-cyano-6-methylsulfanyl-2-oxo-3,4-dihydro-1H-pyridin-4-yl]phenolate CAS Name: 2,6-dibromo-4-[(4R)-5-cyano-6-(methylthio)-2-oxo-3,4-dihydro-1H-pyridin-4-yl]phenolate IUPAC Name: 2,6-dibromo-4-[(4R)-5-cyano-6-methylsulfanyl-2-oxo-3,4-dihydro-1H-pyridin-4-yl]phenolate Traditional Name: 2,6-dibromo-4-[(4R)-5-cyano-2-keto-6-(methylthio)-3,4-dihydro-1H-pyridin-4-yl]phenolate Formula: C13H9Br2N2O2S- MolecularWeight: 417.09576

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(CC(=O)N1)C2=CC(=C(C(=C2)Br)[O-])Br)C#N

Isomeric SMILES

CSC1=C([C@H](CC(=O)N1)C2=CC(=C(C(=C2)Br)[O-])Br)C#N

InChI

InChI=1S/C13H10Br2N2O2S/c1-20-13-8(5-16)7(4-11(18)17-13)6-2-9(14)12(19)10(15)3-6/h2-3,7,19H,4H2,1H3,(H,17,18)/p-1/t7-/m1/s1