6-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-1H-benzimidazole

Systemtic Name: 6-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-1H-benzimidazole Openeye Name: 6-chloro-2-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-1H-benzimidazole CAS Name: 6-chloro-2-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-1H-benzimidazole IUPAC Name: 6-chloro-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-1H-benzimidazole Traditional Name: 6-chloro-2-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]-1H-benzimidazole Formula: C13H8ClN3O3S MolecularWeight: 321.73892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)NC(=N2)SC=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)NC(=N2)S/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C13H8ClN3O3S/c14-8-1-3-10-11(7-8)16-13(15-10)21-6-5-9-2-4-12(20-9)17(18)19/h1-7H,(H,15,16)/b6-5+