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

Systemtic Name: 2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-iodanylphenyl)ethanamide Openeye Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-iodophenyl)acetamide CAS Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-iodophenyl)acetamide IUPAC Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-iodophenyl)acetamide Traditional Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-iodophenyl)acetamide Formula: C11H12IN5OS MolecularWeight: 389.21535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CC1=NN=C(N1N)SCC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C11H12IN5OS/c1-7-15-16-11(17(7)13)19-6-10(18)14-9-4-2-3-8(12)5-9/h2-5H,6,13H2,1H3,(H,14,18)