2-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodo-2-methyl-phenyl)acetamide CAS Name: 2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]-N-(4-iodo-2-methylphenyl)acetamide IUPAC Name: 2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodo-2-methylphenyl)acetamide Traditional Name: 2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]-N-(4-iodo-2-methyl-phenyl)acetamide Formula: C13H16IN5OS MolecularWeight: 417.26851

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1N)SCC(=O)NC2=C(C=C(C=C2)I)C

Isomeric SMILES

CCC1=NN=C(N1N)SCC(=O)NC2=C(C=C(C=C2)I)C

InChI

InChI=1S/C13H16IN5OS/c1-3-11-17-18-13(19(11)15)21-7-12(20)16-10-5-4-9(14)6-8(10)2/h4-6H,3,7,15H2,1-2H3,(H,16,20)