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

Systemtic Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-iodanylphenyl)ethanamide Openeye Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-iodophenyl)acetamide CAS Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]thio]-N-(3-iodophenyl)acetamide IUPAC Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-iodophenyl)acetamide Traditional Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]thio]-N-(3-iodophenyl)acetamide Formula: C18H17IN4OS MolecularWeight: 464.32325

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC(=CC=C3)I

Isomeric SMILES

CCC1=CC=CC=C1N2C=NN=C2SCC(=O)NC3=CC(=CC=C3)I

InChI

InChI=1S/C18H17IN4OS/c1-2-13-6-3-4-9-16(13)23-12-20-22-18(23)25-11-17(24)21-15-8-5-7-14(19)10-15/h3-10,12H,2,11H2,1H3,(H,21,24)