3-(1H-benzimidazol-2-ylsulfanylmethyl)-5-(3-iodanylphenyl)-1,2,4-oxadiazole

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-5-(3-iodanylphenyl)-1,2,4-oxadiazole Openeye Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-5-(3-iodophenyl)-1,2,4-oxadiazole CAS Name: 3-[(1H-benzimidazol-2-ylthio)methyl]-5-(3-iodophenyl)-1,2,4-oxadiazole IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-5-(3-iodophenyl)-1,2,4-oxadiazole Traditional Name: 3-[(1H-benzimidazol-2-ylthio)methyl]-5-(3-iodophenyl)-1,2,4-oxadiazole Formula: C16H11IN4OS MolecularWeight: 434.25421

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC3=NOC(=N3)C4=CC(=CC=C4)I

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC3=NOC(=N3)C4=CC(=CC=C4)I

InChI

InChI=1S/C16H11IN4OS/c17-11-5-3-4-10(8-11)15-20-14(21-22-15)9-23-16-18-12-6-1-2-7-13(12)19-16/h1-8H,9H2,(H,18,19)