2-[(2,4-dinitrophenyl)methylsulfanyl]pyridine-4-carbonitrile

Systemtic Name: 2-[(2,4-dinitrophenyl)methylsulfanyl]pyridine-4-carbonitrile Openeye Name: 2-[(2,4-dinitrophenyl)methylsulfanyl]pyridine-4-carbonitrile CAS Name: 2-[(2,4-dinitrophenyl)methylthio]-4-pyridinecarbonitrile IUPAC Name: 2-[(2,4-dinitrophenyl)methylsulfanyl]pyridine-4-carbonitrile Traditional Name: 2-[(2,4-dinitrobenzyl)thio]isonicotinonitrile Formula: C13H8N4O4S MolecularWeight: 316.29202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CSC2=NC=CC(=C2)C#N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CSC2=NC=CC(=C2)C#N

InChI

InChI=1S/C13H8N4O4S/c14-7-9-3-4-15-13(5-9)22-8-10-1-2-11(16(18)19)6-12(10)17(20)21/h1-6H,8H2