4-cyano-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]benzamide

Systemtic Name: 4-cyano-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]benzamide Openeye Name: 4-cyano-N-[(E)-(5-nitro-2-thienyl)methyleneamino]benzamide CAS Name: 4-cyano-N-[(E)-(5-nitro-2-thiophenyl)methylideneamino]benzamide IUPAC Name: 4-cyano-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]benzamide Traditional Name: 4-cyano-N-[(E)-(5-nitro-2-thienyl)methyleneamino]benzamide Formula: C13H8N4O3S MolecularWeight: 300.29262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)NN=CC2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)N/N=C/C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C13H8N4O3S/c14-7-9-1-3-10(4-2-9)13(18)16-15-8-11-5-6-12(21-11)17(19)20/h1-6,8H,(H,16,18)/b15-8+