4-[(E)-2-(1-ethenyl-5-nitro-imidazol-2-yl)ethenyl]benzenecarbothioamide

Systemtic Name: 4-[(E)-2-(1-ethenyl-5-nitro-imidazol-2-yl)ethenyl]benzenecarbothioamide Openeye Name: 4-[(E)-2-(5-nitro-1-vinyl-imidazol-2-yl)vinyl]benzenecarbothioamide CAS Name: 4-[(E)-2-(1-ethenyl-5-nitro-2-imidazolyl)ethenyl]benzenecarbothioamide IUPAC Name: 4-[(E)-2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzenecarbothioamide Traditional Name: 4-[(E)-2-(5-nitro-1-vinyl-imidazol-2-yl)vinyl]thiobenzamide Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

C=CN1C(=CN=C1C=CC2=CC=C(C=C2)C(=S)N)[N+](=O)[O-]

Isomeric SMILES

C=CN1C(=CN=C1/C=C/C2=CC=C(C=C2)C(=S)N)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O2S/c1-2-17-12(16-9-13(17)18(19)20)8-5-10-3-6-11(7-4-10)14(15)21/h2-9H,1H2,(H2,15,21)/b8-5+