2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-(5-nitro-2-furanyl)methylideneamino]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-(5-nitro-2-furyl)methyleneamino]acetamide Formula: C14H11N5O4S MolecularWeight: 345.33324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NN=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC(=O)N/N=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O4S/c20-12(18-15-7-9-5-6-13(23-9)19(21)22)8-24-14-16-10-3-1-2-4-11(10)17-14/h1-7H,8H2,(H,16,17)(H,18,20)/b15-7+