5-(1-methylimidazol-2-yl)sulfanyl-2-nitro-benzenecarbonitrile

Systemtic Name: 5-(1-methylimidazol-2-yl)sulfanyl-2-nitro-benzenecarbonitrile Openeye Name: 5-(1-methylimidazol-2-yl)sulfanyl-2-nitro-benzonitrile CAS Name: 5-[(1-methyl-2-imidazolyl)thio]-2-nitrobenzonitrile IUPAC Name: 5-(1-methylimidazol-2-yl)sulfanyl-2-nitrobenzonitrile Traditional Name: 5-[(1-methylimidazol-2-yl)thio]-2-nitro-benzonitrile Formula: C11H8N4O2S MolecularWeight: 260.27182

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=CC(=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CN1C=CN=C1SC2=CC(=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C11H8N4O2S/c1-14-5-4-13-11(14)18-9-2-3-10(15(16)17)8(6-9)7-12/h2-6H,1H3