2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-4,6-dimethyl-5-nitro-3-pyridinecarbonitrile IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-4,6-dimethyl-5-nitropyridine-3-carbonitrile Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-4,6-dimethyl-5-nitro-nicotinonitrile Formula: C16H13N5O2S MolecularWeight: 339.37172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC2=NC(=C(C(=C2C#N)C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC2=NC(=C(C(=C2C#N)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C16H13N5O2S/c1-8-5-9(2)19-15(12(8)6-17)24-16-13(7-18)10(3)14(21(22)23)11(4)20-16/h5H,1-4H3