5-chloranyl-4,6-dimethyl-2-[(5-nitrofuran-2-yl)methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 5-chloranyl-4,6-dimethyl-2-[(5-nitrofuran-2-yl)methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 5-chloro-4,6-dimethyl-2-[(5-nitro-2-furyl)methylsulfanyl]pyridine-3-carbonitrile CAS Name: 5-chloro-4,6-dimethyl-2-[(5-nitro-2-furanyl)methylthio]-3-pyridinecarbonitrile IUPAC Name: 5-chloro-4,6-dimethyl-2-[(5-nitrofuran-2-yl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 5-chloro-4,6-dimethyl-2-[(5-nitro-2-furyl)methylthio]nicotinonitrile Formula: C13H10ClN3O3S MolecularWeight: 323.7548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1Cl)C)SCC2=CC=C(O2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=C(C(=NC(=C1Cl)C)SCC2=CC=C(O2)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H10ClN3O3S/c1-7-10(5-15)13(16-8(2)12(7)14)21-6-9-3-4-11(20-9)17(18)19/h3-4H,6H2,1-2H3