2-[[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-iodophenyl)ethanamide

Systemtic Name: 2-[[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-iodophenyl)ethanamide Openeye Name: 2-[[5-(2-furyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-iodophenyl)acetamide CAS Name: 2-[[5-(2-furanyl)-1H-1,2,4-triazol-3-yl]thio]-N-(4-iodophenyl)acetamide IUPAC Name: 2-[[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-iodophenyl)acetamide Traditional Name: 2-[[5-(2-furyl)-1H-1,2,4-triazol-3-yl]thio]-N-(4-iodophenyl)acetamide Formula: C14H11IN4O2S MolecularWeight: 426.23221

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=NC(=NN2)SCC(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

C1=COC(=C1)C2=NC(=NN2)SCC(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C14H11IN4O2S/c15-9-3-5-10(6-4-9)16-12(20)8-22-14-17-13(18-19-14)11-2-1-7-21-11/h1-7H,8H2,(H,16,20)(H,17,18,19)