4,6-dimethyl-2-(3-nitropyridin-2-yl)sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-(3-nitropyridin-2-yl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-[(3-nitro-2-pyridyl)sulfanyl]pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[(3-nitro-2-pyridinyl)thio]-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-(3-nitropyridin-2-yl)sulfanylpyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-2-[(3-nitro-2-pyridyl)thio]nicotinonitrile Formula: C13H10N4O2S MolecularWeight: 286.3091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC2=C(C=CC=N2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC2=C(C=CC=N2)[N+](=O)[O-])C

InChI

InChI=1S/C13H10N4O2S/c1-8-6-9(2)16-12(10(8)7-14)20-13-11(17(18)19)4-3-5-15-13/h3-6H,1-2H3